SCHEMBL9577474

SCHEMBL9577474

CC(C)(C(=O)C(=O)O)c1c[nH]c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.47
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GPR84 Q9NQS5 1/20 0.46
NR4A2 P43354 2/20 0.44
MAPK1 P28482 1/20 0.44
CREBBP Q92793 1/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
ATM Q13315 2/20 0.44
CFTR P13569 1/20 0.43
APAF1 O14727 1/20 0.43
POLB P06746 1/20 0.43
RECQL P46063 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADAM17 P78536 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
SCHEMBL25139960 0.83 PBRM1 (0.54) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL5174863 0.82 PBRM1 (0.49) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL5172407 0.82 PBRM1 (0.49) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL17866728 0.80 PBRM1 (0.50) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL25866775 0.79 NR4A2 (0.54) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL25139491 0.79 KDM4E (0.49) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL6288556 0.79 PBRM1 (0.49) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL1810243 0.77 ALDH1A1 (0.47) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL27411346 0.77 PBRM1 (0.47) PBRM1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL6205542 0.77 ALDH1A1 (0.47) PBRM1ALDH1A1KDM4EMAPTKMT2A

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-0407588-B1 PROCESS FOR PRODUCING 2-OXO-3-AROMATIC CARBOXYLIC ACID DERIVATIVES SAGAMI CHEM RES (JP) 1993-12-08 EP disclosed
US-5028738-A Process for producing 2-oxo-3-aromatic carboxylic acid derivatives SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-07-02 US disclosed
EP-0407588-A1 PROCESS FOR PRODUCING 2-OXO-3-AROMATIC CARBOXYLIC ACID DERIVATIVES SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-16 EP disclosed