SCHEMBL10714044

SCHEMBL10714044

CSC1C(=O)Nc2c(-c3ccccc3)cc(Cl)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPM2 O94759 1/20 0.38
▸ CHRM1 P11229 2/20 0.37
▸ METAP2 P50579 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ALB P02768 1/20 0.36
▸ CCKBR P32239 1/20 0.35
▸ CACNB4 O00305 1/20 0.35
▸ CACNA1A O00555 1/20 0.35
▸ CACNA1G O43497 1/20 0.35
▸ CACNG3 O60359 1/20 0.35
▸ CACNA1F O60840 1/20 0.35
▸ CACNA1H O95180 1/20 0.35
▸ CACNB3 P54284 1/20 0.35
▸ CACNA2D1 P54289 1/20 0.35
▸ CACNG7 P62955 1/20 0.35
▸ CACNA1B Q00975 1/20 0.35
▸ CACNA1D Q01668 1/20 0.35
▸ CACNB1 Q02641 1/20 0.35

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
SCHEMBL10713932 0.84 GABRA1 (0.39) TRPM2PTGS2PDE4DLRRK2
SCHEMBL10712219 0.83 GSK3B (0.38) MEN1KMT2ALMNAPGRGSK3B
SCHEMBL10711888 0.80 BRD4 (0.40) PTGS2GSK3B
SCHEMBL10713399 0.78 PGR (0.36) CACNB4CACNA1ACACNA1GCACNG3CACNA1F
SCHEMBL10711665 0.77 MEN1 (0.33) CHRM1MEN1KMT2ALMNAALB
SCHEMBL10711115 0.75 ALDH1A1 (0.36) PTGS2
SCHEMBL10714792 0.75 ALDH1A1 (0.36) TRPM2PGRPTGS2GSK3B
SCHEMBL10711514 0.74 FEN1 (0.34) CHRM1PTGS2
SCHEMBL10921967 0.73 HTT (0.33) CHRM1MEN1KMT2ALMNAPTGS2
SCHEMBL10712822 0.72 ALDH1A1 (0.40) KMT2ACACNB4CACNA1ACACNA1GCACNG3

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 2 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
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
Send feedback