SCHEMBL7514686

SCHEMBL7514686

CC(=O)Nc1c(C(=O)c2ccccc2)[nH]c2ccc(Cl)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
ALDH1A1 P00352 5/20 0.56
MAPT P10636 4/20 0.56
HPGD P15428 4/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
GAA P10253 1/20 0.56
ALOX12 P18054 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MAP2 P11137 3/20 0.53
POLB P06746 1/20 0.53
CNR1 P21554 2/20 0.49
PARP14 Q460N5 1/20 0.49
ATM Q13315 1/20 0.46
HSD17B10 Q99714 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 1/20 0.45
THRB P10828 1/20 0.45

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
SCHEMBL7503003 0.90 KDM4E (0.54) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL7507866 0.85 KDM4E (0.54) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL7505245 0.85 KMT2A (0.56) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL7512238 0.85 KDM4E (0.54) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL7512958 0.84 KDM4E (0.76) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL7509649 0.83 KDM4E (0.65) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL7506093 0.82 KDM4E (0.47) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7504271 0.81 KDM4E (0.47) KDM4EMEN1KMT2APOLBPARP14
SCHEMBL7508837 0.81 KMT2A (0.54) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL7505821 0.81 KDM4E (0.50) KDM4EMEN1KMT2A

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 4 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
EP-1001934-A1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER PHARMACEUTICALS INC. (JP) 2000-05-24 EP disclosed
WO-1999005104-A1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER PHARMACEUTICALS INC. (JP) 1999-02-04 WO disclosed