SCHEMBL944373

SCHEMBL944373

COC(=O)c1c(Cl)ccc(C=NO)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
KMT2A Q03164 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALOX15 P16050 1/20 0.38
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 4/20 0.35
TSHR P16473 2/20 0.35
TAS1R3 Q7RTX0 2/20 0.35
TAS1R1 Q7RTX1 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
NPC1 O15118 2/20 0.34
GAA P10253 2/20 0.33

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
SCHEMBL1671613 0.85 SMN1; SMN2 (0.50) KMT2ARAB9ASMN1; SMN2ALDH1A1TSHR
SCHEMBL12236675 0.85 SMN1; SMN2 (0.50) KMT2ARAB9ASMN1; SMN2ALDH1A1TSHR
SCHEMBL1671615 0.85 SMN1; SMN2 (0.50) KMT2ARAB9ASMN1; SMN2ALDH1A1TSHR
SCHEMBL944679 0.83 ERN1 (0.40) KDM4EKMT2ARAB9AALDH1A1TSHR
SCHEMBL18502965 0.75 KDM4E (0.44) KDM4EKMT2AL3MBTL1RAB9ASMN1; SMN2
SCHEMBL18508561 0.75 KDM4E (0.44) KDM4EKMT2AL3MBTL1RAB9ASMN1; SMN2
SCHEMBL8488636 0.74 ABL1 (0.45) KDM4EKMT2AL3MBTL1RAB9ASMN1; SMN2
SCHEMBL1495245 0.74 CA12 (0.50) KDM4EKMT2AALOX15SMN1; SMN2ALDH1A1
SCHEMBL18329477 0.74 PTGS2 (0.42) KDM4ERAB9ASMN1; SMN2ALDH1A1TSHR
SCHEMBL944683 0.73 MEN1 (0.36) KDM4EKMT2ASMN1; SMN2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057133-B1 DI-AMINO-SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-08-20 EP disclosed
US-8163742-B2 Di-amino-substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2012-04-24 US disclosed
US-7872128-B2 Benzisoxazole and isoxazolo-pyridine compounds and method of use AMGEN INC. (US) 2011-01-18 US disclosed
US-7872128-B2 Benzisoxazole and isoxazolo-pyridine compounds and method of use AMGEN INC. (US) 2011-01-18 US disclosed
EP-2069020-B1 BENZO[D]ISOXAZOLE DERIVATIVES AS C-KIT TYROSINE KINASE INHIBITORS FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH THE OVER PRODUCTION OF HISTAMINE AMGEN INC (US) 2010-01-27 EP disclosed
EP-2069020-A2 BENZO[D]ISOXAZOLE DERIVATIVES AS C-KIT TYROSINE KINASE INHIBITORS FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH THE OVER PRODUCTION OF HISTAMINE Amgen Inc. (US) 2009-06-17 EP disclosed
EP-2057133-A2 DI-AMINO-SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2009-05-13 EP disclosed
US-20080318946-A1 Di-amino-substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2008-12-25 US disclosed
US-20080227779-A1 Heterocyclic compounds and methods of use AMGEN INC. (US) 2008-09-18 US disclosed
US-20080227779-A1 Heterocyclic compounds and methods of use AMGEN INC. (US) 2008-09-18 US disclosed
WO-2008011080-A2 BENZO(D) ISOXAZOLE DERIVATIVES AS C-KIT TYROSINE KINASE INHIBITORS FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH THE OVER PRODUCTION OF HISTAMINE AMGEN INC. (US) 2008-01-24 WO disclosed
WO-2008011110-A2 DI-AMINO-SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2008-01-24 WO 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 (2 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-20080227779-A1 Heterocyclic compounds and methods of use KIT, TPSG1, CMA1 KDM4E 149/4885KMT2A 749/4885L3MBTL1 4555/4885
US-20080318946-A1 Di-amino-substituted heterocyclic compounds and methods of use KIT, CMA1, TPSG1 KDM4E 285/4885KMT2A 647/4885L3MBTL1 4084/4885

“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.