SCHEMBL13467906

SCHEMBL13467906

CBc1cc(C(=O)O)c(=O)n(-c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.53
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 4/20 0.45
HPGD P15428 2/20 0.45
NOTUM Q6P988 3/20 0.44
LMNA P02545 4/20 0.43
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.39
FGFR1 P11362 1/20 0.37
SRC P12931 1/20 0.37
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP1A2 P05177 1/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL679402 0.80 KDM4E (0.57) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL19511938 0.77 KDM4E (0.54) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL18044535 0.76 KDM4E (0.57) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL197601 0.76 KDM4E (0.57) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL27962153 0.76 KDM4E (0.53) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL18044606 0.74 KDM4E (0.54) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL19511810 0.70 KDM4E (0.46) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL2675351 0.69 KDM4E (1.00) KDM4EMAPK1ALDH1A1HPGDLMNA
SCHEMBL1137068 0.68 KDM4E (0.54) KDM4EMAPK1ALDH1A1HPGDNOTUM
SCHEMBL12495098 0.68 KDM4E (0.54) KDM4EMAPK1ALDH1A1HPGDNOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1881976-B1 SUBSTITUTED AMIDE DERIVATIVES AS PROTEIN KINASE INHIBITORS AMGEN INC (US) 2012-10-17 EP disclosed