SCHEMBL7977822

SCHEMBL7977822

Cc1ccc(-c2[nH]c(C)nc2C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.47
HPGD P15428 4/20 0.47
ALDH1A1 P00352 4/20 0.47
GAA P10253 3/20 0.47
MEN1 O00255 1/20 0.47
GLA P06280 1/20 0.47
KMT2A Q03164 1/20 0.47
USP2 O75604 1/20 0.45
HSD17B10 Q99714 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
PIN1 Q13526 2/20 0.42
RAB9A P51151 1/20 0.41
ALPL P05186 1/20 0.41
CDC7 O00311 1/20 0.41
IKBKB O14920 2/20 0.41
MAPT P10636 1/20 0.40
DHODH Q02127 2/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL5763126 0.88 KDM4E (0.58) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL14705882 0.87 HAO2 (0.44) KDM4EHPGDSMN1; SMN2PIN1ALPL
SCHEMBL7995185 0.82 ALDH1A1 (0.51) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL20376630 0.82 KDM4E (0.47) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL7978027 0.81 KDM4E (0.67) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL7995189 0.81 KDM4E (0.43) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL14705953 0.80 ESR1 (0.46) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL7977738 0.79 MAPK14 (0.56) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL7992039 0.79 MAPK14 (0.56) KDM4EHPGDALDH1A1GAAMEN1
SCHEMBL7977380 0.77 MEN1 (0.56) KDM4EHPGDALDH1A1GAAMEN1

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
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed