SCHEMBL6650992

SCHEMBL6650992

COc1cccc(C(=O)c2ccc(N)cc2)c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
KMT2A Q03164 2/20 0.49
HSD17B10 Q99714 1/20 0.49
STS P08842 1/20 0.49
LMNA P02545 3/20 0.47
ALDH1A1 P00352 1/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 2/20 0.47
CYP19A1 P11511 1/20 0.47
TUBB4A P04350 5/20 0.46
TUBB P07437 5/20 0.46
TUBA3C P0DPH7 5/20 0.46
TUBA1B P68363 5/20 0.46
TUBA4A P68366 5/20 0.46
TUBB4B P68371 5/20 0.46
TUBB3 Q13509 5/20 0.46
TUBB2A Q13885 5/20 0.46
TUBB8 Q3ZCM7 5/20 0.46
TUBA3E Q6PEY2 5/20 0.46
TUBA1A Q71U36 5/20 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
SCHEMBL28872783 0.86 MAPT (0.58) GAAKMT2AHSD17B10STSLMNA
SCHEMBL29986971 0.85 MAPT (0.57) GAAKMT2AHSD17B10STSLMNA
SCHEMBL322169 0.85 MAPT (0.57) GAAKMT2AHSD17B10STSLMNA
SCHEMBL6656065 0.85 STS (0.64) GAAKMT2AHSD17B10STSLMNA
SCHEMBL28095416 0.84 MAPT (0.55) GAAKMT2AHSD17B10STSLMNA
SCHEMBL3762150 0.83 RAB9A (0.55) GAAKMT2AHSD17B10LMNAALDH1A1
SCHEMBL4230721 0.81 RAB9A (0.53) GAAKMT2AHSD17B10LMNAALDH1A1
SCHEMBL11764286 0.81 CYP1A2 (0.64) GAAKMT2AALDH1A1NPC1RAB9A
Benzoic Acid SCHEMBL28087661 0.81 MAPT (0.53) GAAKMT2AHSD17B10LMNAALDH1A1
SCHEMBL29039855 0.81 LMNA (0.63) GAAKMT2AHSD17B10LMNAALDH1A1

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-0966424-B1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF LEO PHARMA AS (DK) 2004-06-23 EP disclosed
US-6313174-B1 FOR THERAPY AND PROPHYLAXIS OF ASTHMA, ALLERGY, RHEUMATOID ARTHRITIS, SPONDYLOARTHRITIS, GOUT, ATHEROSCLEROSIS, CHRONIC INFLAMMATORY BOWEL DISEASE, PROLIFERATIVE AND INFLAMMATORY SKIN DISORDERS Leo Pharmaceutical Products Ltd.A/S/ (Løvens kemiske Fabrik Produktionsaktieselskab) (DK) 2001-11-06 US disclosed
EP-0966424-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 1999-12-29 EP disclosed
WO-1998032730-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 1998-07-30 WO disclosed