SCHEMBL2960184

SCHEMBL2960184

Cc1ccc2c(c1)C(=O)N(C(=O)OC(C)(C)C)C2=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 3/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
PIK3CA P42336 1/20 0.43
BCHE P06276 1/20 0.41
GPR119 Q8TDV5 2/20 0.41
LPAR1 Q92633 1/20 0.40
LPAR3 Q9UBY5 1/20 0.40
CHRM2 P08172 1/20 0.39
PDE5A O76074 1/20 0.39
ACHE P22303 1/20 0.39
TP53 P04637 1/20 0.39
CA2 P00918 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL12576098 0.83 PIK3CA (0.42) CA9CA1PIK3CABCHECA2
SCHEMBL30513026 0.83 ALDH1A1 (0.46) CA9CA1PIK3CABCHECA2
SCHEMBL18485406 0.82 CA9 (0.49) CA9CA12CA1LPAR1LPAR3
SCHEMBL5121655 0.82 BCHE (0.54) CA9CA12PIK3CABCHEGPR119
SCHEMBL18485397 0.81 ALDH1A1 (0.50) CA9CA12CA1LPAR1LPAR3
SCHEMBL29658511 0.81 ACHE (0.59) BCHEPDE5AACHETP53KMT2A
SCHEMBL19716597 0.81 ACHE (0.59) BCHEPDE5AACHETP53KMT2A
SCHEMBL2954707 0.80 PIK3CA (0.40) PIK3CABCHETP53
SCHEMBL21051864 0.79 CA12 (0.49) CA9CA12CA1ACHECA2
SCHEMBL5958855 0.78 CRBN (0.42) CA9CA12CA1PIK3CAGPR119

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
EP-1445249-B1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-07 EP disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
EP-1445249-A1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2004-08-11 EP disclosed