SCHEMBL10921967

SCHEMBL10921967

CSC1C(=O)Nc2c(Cl)cc(Cl)c(-c3ccccc3)c21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.33
▸ TYMP P19971 1/20 0.32
▸ PDE5A O76074 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ PDE1A P54750 1/20 0.32
▸ PDE1B Q01064 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ PDE4C Q08493 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ PDE7A Q13946 1/20 0.32
▸ PDE1C Q14123 1/20 0.32
▸ PDE7B Q9NP56 1/20 0.32
▸ HTR6 P50406 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ CHRM1 P11229 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
SCHEMBL10711665 0.77 MEN1 (0.33) MEN1KMT2AHPGDPTGS2CHRM1
SCHEMBL10715803 0.77 BRD4 (0.35) MAPTPTGS2CHRM1
SCHEMBL10714044 0.73 TRPM2 (0.38) PDE4DMEN1KMT2APTGS2CHRM1
SCHEMBL10711636 0.71 CES1 (0.36) MAPTKMT2ALMNA
SCHEMBL11094095 0.71 FFAR1 (0.35) —
SCHEMBL10713397 0.69 BRD4 (0.33) PDE4APDE4BPDE4CPDE4DPTGS2
SCHEMBL10714781 0.69 METAP2 (0.35) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL11853355 0.67 ALDH1A1 (0.36) MEN1KMT2A
SCHEMBL10712282 0.67 BRD4 (0.36) MAPTMEN1GAAKMT2AHPGD
SCHEMBL10714792 0.67 ALDH1A1 (0.36) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0089426-B1 2-AMINO-6-BIPHENYLACETIC ACIDS A.H. ROBINS COMPANY, INCORPORATED (US) 1986-06-11 — — EP 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
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