SCHEMBL734480

SCHEMBL734480

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nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.65
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 1/20 0.32
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 2/20 0.32
ALDH1A1 P00352 1/20 0.31
HTR1A P08908 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
NMUR2 Q9GZQ4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP2C9 P11712 1/20 0.31
HIF1A Q16665 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
LMNA P02545 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ANPEP P15144 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
SCHEMBL12357051 1.00 KDM4E (0.65) KDM4ESMN1; SMN2TSHRSLC6A2SLC6A4
SCHEMBL12737720 0.83
SCHEMBL19672356 0.83
SCHEMBL13997259 0.83 KDM4E (0.58) KDM4ESMN1; SMN2TSHRSLC6A2ALDH1A1
Meglumine SCHEMBL4274398 0.80 KDM4E (0.91) KDM4ESMN1; SMN2TSHRSLC6A2SLC6A4
SCHEMBL414431 0.80 TSHR (0.47) KDM4ETSHRALDH1A1TDP1LMNA
SCHEMBL12409518 0.80 TSHR (0.47) KDM4ETSHRALDH1A1TDP1LMNA
SCHEMBL15496474 0.80 TSHR (0.47) KDM4ETSHRALDH1A1TDP1LMNA
Meglumine SCHEMBL23106596 0.79 KDM4E (1.00) KDM4ESMN1; SMN2TSHRSLC6A2SLC6A4
Meglumine SCHEMBL22562873 0.79 KDM4E (1.00) KDM4ESMN1; SMN2TSHRSLC6A2SLC6A4

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2017-11-23 US disclosed
US-9783503-B2 Crystalline forms of an estrogen receptor modulator GENENTECH, INC. (US) 2017-10-10 US disclosed
US-9758484-B2 Base addition salts of nitroxoline and uses thereof ASIERIS PHARMACEUTICAL TECHNOLOGIES CO., LTD. (CN) 2017-09-12 US disclosed
US-9586885-B2 Compounds for use in the treatment of inflammatory bowel disease VENANTIUS LIMITED (IE) 2017-03-07 US disclosed
US-20160039770-A1 CRYSTALLINE FORMS OF AN ESTROGEN RECEPTOR MODULATOR GENENTECH, INC. (US) 2016-02-11 US disclosed
US-20160031819-A1 BASE ADDITION SALTS OF NITROXOLINE AND USES THEREOF PAN-SCIENTIFIC HOLDINGS CO., LTD. (VG) 2016-02-04 US disclosed
US-8735602-B2 Pharmaceutically acceptable salts of thymodepressin and processes for their manufacture APOTEX TECHNOLOGIES INC. (CA) 2014-05-27 US disclosed
US-20140107194-A1 COMPOUNDS FOR USE IN THE TREATMENT OF IMMUNE RELATED INFLAMMATORY DISEASE VENANTIUS LIMITED (IE) 2014-04-17 US disclosed
US-20130072692-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF THYMODEPRESSIN AND PREOCESSES FOR THEIR MANUFACTURE. APOTEX TECHNOLOGIES INC. (CA) 2013-03-21 US disclosed
US-20130017156-A1 CEFDINIR AND CEFIXIME FORMULATIONS AND USES THEREOF BILGIC MAHMUT (TR) 2013-01-17 US disclosed
US-8138221-B2 Pharmaceutically acceptable salts of thymodepressin and processes for their manufacture APOTEX TECHNOLOIGES INC. (CA) 2012-03-20 US disclosed
US-20100286041-A1 (5Z)-5-(6-QUINOXALINYLMETHYLIDENE)-2-[(2,6-DICHLOROPHENYL)AMINO]-1,3-THIAZOL-4(5H)-ONE SMITHKLINE BEECHAM CORPORATION 2010-11-11 US disclosed
US-20100184774-A1 METHODS OF TREATMENT SMITHKLINE BEECHAM CORPORATION 2010-07-22 US disclosed
US-7674792-B2 5(Z)-5-(6-quinoxalinylmethylidene)-2-[2,6-dichlorophenyl)amino]-1,3-thiazol-4(5H)-one GLAXOSMITHKLINE LLC (US) 2010-03-09 US disclosed
US-20100056803-A1 Pharmaceutically Acceptable Salts of Thymodepressin and Processes for their Manufacture APOTEX TECHNOLOGIES INC. (CA) 2010-03-04 US disclosed
US-20070179144-A1 for treatment of deficiencies in hematopoietic cells GLAXOSMITHKLINE LLC 2007-08-02 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 (10 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-20130072692-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF THYMODEPRESSIN AND PREOCESSES FOR THEIR MANUFACTURE. TPH1, TMSB10, TRPC1 KDM4E 2875/4885SMN1; SMN2 4008/4885TSHR 3344/4885
US-20140107194-A1 COMPOUNDS FOR USE IN THE TREATMENT OF IMMUNE RELATED INFLAMMATORY DISEASE AADAT, ASNS, BCAT2 KDM4E 2185/4885SMN1; SMN2 4025/4885TSHR 731/4885
US-20130017156-A1 CEFDINIR AND CEFIXIME FORMULATIONS AND USES THEREOF C1R, CFD, CSF3R KDM4E 2705/4885SMN1; SMN2 3862/4885TSHR 3260/4885
US-20100286041-A1 (5Z)-5-(6-QUINOXALINYLMETHYLIDENE)-2-[(2,6-DICHLOROPHENYL)AMINO]-1,3-THIAZOL-4(5H)-ONE HYPK, HIPK3, HIPK1 KDM4E 1579/4885SMN1; SMN2 4529/4885TSHR 4322/4885
US-20100056803-A1 Pharmaceutically Acceptable Salts of Thymodepressin and Processes for their Manufacture TPH1, CACNA1G, CACNA1S KDM4E 2406/4885SMN1; SMN2 3873/4885TSHR 2764/4885
US-20160039770-A1 CRYSTALLINE FORMS OF AN ESTROGEN RECEPTOR MODULATOR ESR1, GPER1, ESR2 KDM4E 962/4885SMN1; SMN2 3979/4885TSHR 187/4885
US-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER AK2, PC, GLS2 KDM4E 1333/4885SMN1; SMN2 3394/4885TSHR 3129/4885
US-20070179144-A1 for treatment of deficiencies in hematopoietic cells HCLS1, HIPK3, HYPK KDM4E 1151/4885SMN1; SMN2 2530/4885TSHR 4810/4885
US-20100184774-A1 METHODS OF TREATMENT OPRL1, BRCA1, PKD1 KDM4E 2784/4885SMN1; SMN2 113/4885TSHR 77/4885
US-20160031819-A1 BASE ADDITION SALTS OF NITROXOLINE AND USES THEREOF SLC28A1, SLC28A2, NNT KDM4E 4309/4885SMN1; SMN2 1366/4885TSHR 3085/4885

“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.