SCHEMBL7501257

SCHEMBL7501257

CCCCCCC(=O)Nc1c(C(=O)c2ccccc2)[nH]c2cc(Cl)ccc12

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.49
GSK3B P49841 4/20 0.49
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CNR1 P21554 1/20 0.47
TSHR P16473 1/20 0.44
SPHK2 Q9NRA0 1/20 0.43
SPHK1 Q9NYA1 1/20 0.43

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
SCHEMBL7507890 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7504311 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7508748 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7505284 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7506242 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7507638 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7508929 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7506263 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7508244 1.00 ALOX15 (0.49) ALOX15GSK3BALDH1A1HPGDHSD17B10
SCHEMBL7514736 0.99 ALOX15 (0.48) ALOX15GSK3BALDH1A1HPGDHSD17B10

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