SCHEMBL10712932

SCHEMBL10712932

CSC1C(=O)Nc2cccc(-c3cc(Br)cc(Br)c3)c21

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 6/20 0.34
BRD4 O60885 5/20 0.34
GABRA1 P14867 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
MAPT P10636 3/20 0.32
KMT2A Q03164 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
TDP2 O95551 1/20 0.32
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
BRPF1 P55201 1/20 0.30

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
SCHEMBL10711747 0.83 CREBBP (0.43) CREBBPBRD4GABRA1GABRA5GABRA3
SCHEMBL10711960 0.80 PGR (0.47) CREBBPBRD4MAPTKMT2ATDP2
SCHEMBL10921424 0.76 CCNB2 (0.39) CREBBPBRD4NPSR1MAPTKMT2A
SCHEMBL10710481 0.76 PGR (0.51) MAPTKMT2ATDP2
SCHEMBL10711962 0.75 PGR (0.35) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL10714011 0.73 CREBBP (0.49) CREBBPNPSR1MAPTKMT2ATP53
SCHEMBL15327926 0.72 CREBBP (0.36) CREBBPBRD4MAPTDDB1CRBN
SCHEMBL10712211 0.71 KMT2A (0.45) GABRA1GABRA5GABRA3GABRA2MAPT
SCHEMBL10713995 0.71 HDAC4 (0.45) CREBBPMAPTTP53TDP2
SCHEMBL6181613 0.69 DDB1 (0.41) CREBBPTP53DDB1CRBNBRPF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4670566-A ANTIIFLAMMATORY AGENTS, ANTICOAGULANTS A. H. ROBINS COMPANY, INCORPORATED (US) 1987-06-02 US disclosed
EP-0089426-B1 2-AMINO-6-BIPHENYLACETIC ACIDS A.H. ROBINS COMPANY, INCORPORATED (US) 1986-06-11 EP disclosed
US-4440785-A Methods of using 2-aminobiphenylacetic acids, esters, and metal salts thereof to treat inflammation A. H. ROBINS COMPANY, INC. (US) 1984-04-03 US disclosed
EP-0089426-A1 2-Amino-6-biphenylacetic acids A.H. ROBINS COMPANY, INCORPORATED (US) 1983-09-28 EP disclosed
US-4333951-A MUSCLE RELAXANTS, ANTIINFLAMMATORY AGENTS A. H. ROBINS COMPANY, INC. (US) 1982-06-08 US disclosed