SCHEMBL6651963

SCHEMBL6651963

Nc1ccc(C(=O)c2cc(Cl)cc(Cl)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.53
CNR2 P34972 7/20 0.53
SRD5A2 P31213 1/20 0.47
MAPK1 P28482 1/20 0.47
TPMT P51580 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
HTT P42858 2/20 0.43
HPGD P15428 1/20 0.43
PBRM1 Q86U86 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7194361 0.92 CNR1 (0.46) CNR1CNR2SRD5A2MAPK1CA12
SCHEMBL4747566 0.85 SRD5A2 (0.64) CNR1CNR2SRD5A2MAPK1CA12
SCHEMBL11850424 0.85 CNR1 (0.69) CNR1CNR2SRD5A2MAPK1TPMT
SCHEMBL7940092 0.84 CA12 (0.53) SRD5A2CA12CA1CA2CA9
SCHEMBL6657337 0.82 PARP1 (0.58) CA1CA2CA9PBRM1SMN1; SMN2
SCHEMBL4465360 0.82 TPMT (0.65) CNR1CNR2SRD5A2MAPK1TPMT
SCHEMBL204877 0.82 CA12 (0.59) SRD5A2CA12CA1CA2CA9
SCHEMBL9097535 0.82 CA12 (0.59) SRD5A2CA12CA1CA2CA9
SCHEMBL62657 0.82 CA12 (0.59) SRD5A2CA12CA1CA2CA9
SCHEMBL9360597 0.81 MAPK1 (0.72) CNR1CNR2SRD5A2MAPK1TPMT

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