SCHEMBL7515430

SCHEMBL7515430

Cc1cc(C(=O)c2[nH]c3cc(Cl)ccc3c2NC(=O)CC(C)C)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
MCL1 Q07820 4/20 0.43
BCL2 P10415 2/20 0.43
TP53 P04637 1/20 0.40
ALOX15 P16050 5/20 0.39
TSHR P16473 1/20 0.38
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL7501923 0.87 KDM4E (0.48) KDM4EMCL1ALOX15TSHRALDH1A1
SCHEMBL7511408 0.86 KDM4E (0.48) KDM4EMCL1TP53ALOX15ALDH1A1
SCHEMBL7505878 0.85 KDM4E (0.52) KDM4EMCL1ALDH1A1MAPTHPGD
SCHEMBL7501468 0.82 KDM4E (0.44) KDM4EMCL1ALOX15TSHRALDH1A1
SCHEMBL7512389 0.81 MAPT (0.47) KDM4EMCL1ALDH1A1MAPTHPGD
SCHEMBL7514911 0.80 KDM4E (0.47) KDM4EMCL1BCL2TP53ALOX15
SCHEMBL7505936 0.79 KDM4E (0.44) KDM4EMCL1ALOX15ALDH1A1LMNA
SCHEMBL7511741 0.78 KDM4E (0.43) KDM4ETP53ALOX15ALDH1A1MAPT
SCHEMBL7509500 0.77 KDM4E (0.43) KDM4EMCL1ALOX15TSHRALDH1A1
SCHEMBL7512768 0.76 KDM4E (0.43) KDM4EMCL1TP53ALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1001934-B1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER (US) 2002-11-27 EP disclosed
US-6300363-B1 USEFUL IN THE TREATMENT OR ALLEVIATION OF INFLAMMATION AND OTHER INFLAMMATION ASSOCIATED DISORDERS IN MAMMALS PFIZER INC. 2001-10-09 US disclosed