SCHEMBL8374845

SCHEMBL8374845

N=C1N(CCC(=O)O)CCN1O[PH](=O)O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ SIRT1 Q96EB6 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ S1PR1 P21453 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8371655 0.83 CYP2D6 (0.35) KDM4EPOLBKMT2ATDP1
SCHEMBL8374847 0.76 — —
SCHEMBL7819308 0.69 KDM4E (0.36) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL14510749 0.67 KDM4E (0.37) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL938191 0.66 KMT2A (0.39) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL11227178 0.65 KDM4E (0.44) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL6070489 0.61 KMT2A (0.44) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL17234253 0.60 CYP2D6 (0.44) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL7504798 0.60 KMT2A (0.51) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL11226068 0.60 KDM4E (0.40) KDM4EMEN1POLBMAPTKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434753-B2 Modified creatine compounds GENCIA CORPORATION (US) 2016-09-06 — — US disclosed
US-20150005258-A1 Modified Creatine Compounds Genci Corporation (US) 2015-01-01 — — US disclosed
US-20140045798-A1 MITOCHONDRIAL COMPOSITIONS AND USES THEREOF GENCIA CORPORATION (US) 2014-02-13 — — US disclosed
WO-2013043580-A2 MODIFIED CREATINE COMPOUNDS GENCIA CORPORATION (US) 2013-03-28 — — WO disclosed
US-20130072462-A1 Mitochondrial Compositions and Uses Thereof GENCIA CORPORATION (US) 2013-03-21 — — US disclosed
US-20120141391-A1 Use of creatine or creatine compounds for skin preservation AVICENA GROUP, INC. (US) 2012-06-07 — — US disclosed
US-20110085993-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2011-04-14 — — US disclosed
US-20110021632-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2011-01-27 — — US disclosed
US-20110008272-A1 Use of Creatine or Creatine Compounds for Skin Preservation AVICENA GROUP, INC. (US) 2011-01-13 — — US disclosed
US-20100329997-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2010-12-30 — — US disclosed
US-20100303840-A1 USE OF CREATINE OR CREATINE ANALOGS FOR THE TREATMENT OF DISEASES OF THE NERVOUS SYSTEM AVICENA GROUP, INC. (US) 2010-12-02 — — US disclosed
US-20100226870-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION AVICENA GROUP, INC. (US) 2010-09-09 — — US disclosed
US-20100179106-A1 MITOCHONDRIAL COMPOSITIONS AND USES THEREOF GENCIA CORPORATION (US) 2010-07-15 — — US disclosed
US-20090298943-A1 Use of creatine analogues and creatine kinase modulators for the prevention and treatment of obesity and its related disorders AVICENA GROUP, INC. (US) 2009-12-03 — — US disclosed
US-20080119450-A1 Use of creatine or creatine analogs for the treatment of diseases of the nervous system AVICENA GROUP, INC. (US) 2008-05-22 — — US disclosed
US-20070253944-A1 Use of creatine or creatine compounds for skin preservation AVICENA GROUP, INC. (US) 2007-11-01 — — US disclosed
US-7285573-B2 Use of creatine or creatine analogs for the treatment of diseases of the nervous system AVICENA GROUP, INC. (US) 2007-10-23 — — US disclosed
US-7186754-B2 Use of creatine or creatine compounds for skin preservation AVICENA GROUP, INC. (US) 2007-03-06 — — US disclosed
US-6706764-B2 TREATMENT OF DIABETIC AND TOXIC NEUROPATHIES, PERIPHERAL NERVOUS SYSTEM DISEASES, ALZHEIMER DISEASE, PARKINSON'S DISEASE, STROKE, HUNTINGTON'S DISEASE, AMYOTROPIC LATERAL SCLEROSIS AVICENA GROUP, INC. 2004-03-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140045798-A1 MITOCHONDRIAL COMPOSITIONS AND USES THEREOF CS, UQCRC1, UQCRC2 KDM4E 3876/4885MEN1 800/4885POLB 714/4885
US-20110008272-A1 Use of Creatine or Creatine Compounds for Skin Preservation PC, CKMT1A; CKMT1B, CHEK1 KDM4E 1339/4885MEN1 3935/4885POLB 352/4885
US-20120141391-A1 Use of creatine or creatine compounds for skin preservation PC, CKMT1A; CKMT1B, CHEK1 KDM4E 1339/4885MEN1 3935/4885POLB 352/4885
US-20100329997-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 KDM4E 1339/4885MEN1 3935/4885POLB 352/4885
US-20100303840-A1 USE OF CREATINE OR CREATINE ANALOGS FOR THE TREATMENT OF DISEASES OF THE NERVOUS SYSTEM CKMT1A; CKMT1B, PC, PCK2 KDM4E 3280/4885MEN1 4080/4885POLB 611/4885
US-20110021632-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 KDM4E 1339/4885MEN1 3935/4885POLB 352/4885
US-20100226870-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 KDM4E 1339/4885MEN1 3935/4885POLB 352/4885
US-20070253944-A1 Use of creatine or creatine compounds for skin preservation PC, CKMT1A; CKMT1B, CHEK1 KDM4E 1339/4885MEN1 3935/4885POLB 352/4885
US-20090298943-A1 Use of creatine analogues and creatine kinase modulators for the prevention and treatment of obesity and its related disorders CKMT1A; CKMT1B, PCK1, TKT KDM4E 1038/4885MEN1 4302/4885POLB 2134/4885
US-20110085993-A1 USE OF CREATINE OR CREATINE COMPOUNDS FOR SKIN PRESERVATION PC, CKMT1A; CKMT1B, CHEK1 KDM4E 1339/4885MEN1 3935/4885POLB 352/4885
US-20130072462-A1 Mitochondrial Compositions and Uses Thereof UQCRC1, CS, UQCRC2 KDM4E 3692/4885MEN1 1039/4885POLB 602/4885
US-20100179106-A1 MITOCHONDRIAL COMPOSITIONS AND USES THEREOF PC, CKMT1A; CKMT1B, SLC25A1 KDM4E 3841/4885MEN1 594/4885POLB 973/4885
US-20150005258-A1 Modified Creatine Compounds CKMT1A; CKMT1B, SLC25A20, ARG2 KDM4E 1279/4885MEN1 4191/4885POLB 1245/4885
US-20080119450-A1 Use of creatine or creatine analogs for the treatment of diseases of the nervous system CKMT1A; CKMT1B, PC, PCK2 KDM4E 3280/4885MEN1 4080/4885POLB 611/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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