SCHEMBL10030729

SCHEMBL10030729

CCCCCCCCC(CCCCCCCCC(=O)NCCNC(=O)CCCCCCCCC(CCCCCCCC)C(CCCCCCCC)CCCCCCCCC(=O)OCCOc1ccccc1)C(CCCCCCCC)CCCCCCCCC(=O)OCCOc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.56
TAAR1 Q96RJ0 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
RECQL P46063 2/20 0.49
CNR2 P34972 5/20 0.48
CNR1 P21554 2/20 0.48
MAPT P10636 1/20 0.48
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
TSHR P16473 1/20 0.46
EPHX2 P34913 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL19617998 1.00 HPGD (0.56) HPGDTAAR1SMN1; SMN2MEN1KMT2A
SCHEMBL15478179 0.94 HPGD (0.50) HPGDTAAR1SMN1; SMN2MEN1KMT2A
SCHEMBL10030734 0.91 THRB (0.50) HPGDTAAR1SMN1; SMN2MEN1KMT2A
SCHEMBL10030730 0.89 HPGD (0.54) HPGDTAAR1CNR2HDAC1HDAC2
SCHEMBL10030728 0.86 EPHX2 (0.50) HPGDHDAC1HDAC2EPHX2
SCHEMBL838460 0.85 MAPT (0.50) SMN1; SMN2CNR2CNR1MAPT
SCHEMBL10030727 0.84 MEN1 (0.57) HPGDMEN1KMT2AEPHX2
SCHEMBL15917151 0.84 HPGD (0.41) HPGDTAAR1SMN1; SMN2MEN1KMT2A
SCHEMBL13182760 0.84 MAPT (0.47) SMN1; SMN2CNR2CNR1MAPT
SCHEMBL3230032 0.83 DGKA (0.66) HDAC1HDAC2TSHR

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 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11143958-B2 Method for applying curable gellant composition for digital embossing and other raised print applications XEROX CORPORATION (US) 2021-10-12 US disclosed
US-20190310550-A1 Method For Applying Curable Gellant Composition For Digital Embossing And Other Raised Print Applications XEROX CORPORATION 2019-10-10 US disclosed
EP-3312246-B1 INK COMPOSITION COMPRISING PHASE CHANGE TRANSFER ADDITIVE FOR DIGITAL OFFSET PRINTING XEROX CORP (US) 2019-07-24 EP disclosed
US-10308827-B2 Ink jet ink compositions for digital manufacturing of transparent objects XEROX CORPORATION (US) 2019-06-04 US disclosed
EP-3312246-A1 INK COMPOSITION COMPRISING PHASE CHANGE TRANSFER ADDITIVE FOR DIGITAL OFFSET PRINTING Xerox Corporation (US) 2018-04-25 EP disclosed
US-20180105712-A1 Ink Composition Comprising Phase Change Transfer Additive For Digital Offset Printing XEROX CORPORATION 2018-04-19 US disclosed
US-20180105712-A1 Ink Composition Comprising Phase Change Transfer Additive For Digital Offset Printing XEROX CORPORATION 2018-04-19 US disclosed
US-20180072899-A1 PHASE-CHANGE DIGITAL ADVANCED LITHOGRAPHIC IMAGING INKS WITH AMIDE GELLANT TRANSFER ADDITIVES XEROX CORPORATION 2018-03-15 US disclosed
US-20180072899-A1 PHASE-CHANGE DIGITAL ADVANCED LITHOGRAPHIC IMAGING INKS WITH AMIDE GELLANT TRANSFER ADDITIVES XEROX CORPORATION 2018-03-15 US disclosed
US-20170275486-A1 Curable Gellant Ink Composition XEROX CORPORATION 2017-09-28 US disclosed
US-8084637-B2 Amide gellant compounds with aromatic end groups XEROX CORPORATION (US) 2011-12-27 US disclosed
US-8084637-B2 Amide gellant compounds with aromatic end groups XEROX CORPORATION (US) 2011-12-27 US disclosed
US-20110262643-A1 INK COMPOSITIONS AND METHODS XEROX CORPORATION (US) 2011-10-27 US disclosed
US-20110262711-A1 CURABLE COMPOSITIONS FOR THREE-DIMENSIONAL PRINTING XEROX CORPORATION (US) 2011-10-27 US disclosed
US-20110262643-A1 INK COMPOSITIONS AND METHODS XEROX CORPORATION (US) 2011-10-27 US disclosed
US-20110263890-A1 Amide Gellant Compounds With Aromatic End Groups XEROX CORPORATION (US) 2011-10-27 US disclosed
US-20110263769-A1 Phase Change Inks Containing Amide Gellant Compounds With Aromatic End Groups XEROX CORPORATION (US) 2011-10-27 US disclosed
US-20110263769-A1 Phase Change Inks Containing Amide Gellant Compounds With Aromatic End Groups XEROX CORPORATION (US) 2011-10-27 US disclosed
US-20110263890-A1 Amide Gellant Compounds With Aromatic End Groups XEROX CORPORATION (US) 2011-10-27 US disclosed
US-20110262711-A1 CURABLE COMPOSITIONS FOR THREE-DIMENSIONAL PRINTING XEROX CORPORATION (US) 2011-10-27 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 (1 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-20110263890-A1 Amide Gellant Compounds With Aromatic End Groups NAT1, AGPAT2, CCNT1 HPGD 3248/4885TAAR1 380/4885SMN1; SMN2 4399/4885

“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.