SCHEMBL7500668

SCHEMBL7500668

COc1ccc2ccccc2c1C(=O)c1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.52
CNR2 P34972 3/20 0.50
HSP90AA1 P07900 1/20 0.50
CNR1 P21554 1/20 0.48
MAPT P10636 3/20 0.47
KMT2A Q03164 3/20 0.47
KDM4E B2RXH2 3/20 0.47
MEN1 O00255 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
HPGD P15428 3/20 0.46
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46

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
SCHEMBL7706394 0.88 CTSD (0.60) CTSDCNR2CNR1MAPTKMT2A
SCHEMBL11574652 0.87 ALDH1A1 (0.54) CTSDCNR2CNR1MAPTKMT2A
SCHEMBL23499947 0.86 CNR2 (0.59) CTSDCNR2CNR1MAPTKMT2A
SCHEMBL27763766 0.84 PDE10A (0.51) HSP90AA1MAPTHTTSMN1; SMN2GAA
SCHEMBL27740228 0.82 MAPT (0.52) HSP90AA1MAPTKMT2AKDM4EMEN1
SCHEMBL28006245 0.80 MAPT (0.55) CTSDCNR2CNR1MAPTKMT2A
SCHEMBL29625745 0.79 ABCG2 (0.57) CTSDCNR2CNR1MAPTKMT2A
SCHEMBL24954211 0.79 ABCG2 (0.57) CTSDCNR2CNR1MAPTKMT2A
SCHEMBL8418472 0.78 CYP1B1 (0.50) MAPTKMT2AKDM4EMEN1HTT
SCHEMBL3357585 0.78 NCEH1 (0.65) CTSDCNR2CNR1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1159293-C 5-aroylnaphthalene derivatives - 2004-07-28 CN disclosed
EP-0966437-B1 5-AROYLNAPHTHALENE DERIVATIVES HOFFMANN LA ROCHE (CH) 2002-06-12 EP disclosed
US-6150397-A 5-(PYRIDYL, FURYL, OR THIENYL SUBSTITUTED)-6-SUBSTITUTED-2--2-NAPHTHALENESULFONAMIDES OF GIVEN FORMULA; INHIBITORS OF PROSTAGLANDIN G/H SYNTHASE; TREATING INFLAMMATORY DISEASE SUCH AS GOUT, ARTHRITIS, MYOSITIS, SYNOVITIS SYNTEX (U.S.A.) INC. (US) 2000-11-21 US disclosed
CN-1246109-A 5-aroylnaphthalene derivatives HOFFMANN LA ROCHE (CH) 2000-03-01 CN disclosed
EP-0966437-A1 5-AROYLNAPHTHALENE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 1999-12-29 EP disclosed
US-5962531-A PROSTAGLANDIN SYNTHASE INHIBITOR; RHEUMATIC DISORDERS SYNTEX (U.S.A.) INC. (US) 1999-10-05 US disclosed
WO-1998032732-A1 5-AROYLNAPHTHALENE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1998-07-30 WO disclosed