SCHEMBL6972148

SCHEMBL6972148

CCc1c(C(=O)O)ccc(CBr)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.36
GABRP O00591 2/20 0.36
GABRD O14764 2/20 0.36
GABRA1 P14867 2/20 0.36
GABRB1 P18505 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
GABRA2 P47869 2/20 0.36
GABRB2 P47870 2/20 0.36
GABRA4 P48169 2/20 0.36
GABRE P78334 2/20 0.36
GABRA6 Q16445 2/20 0.36
GABRG1 Q8N1C3 2/20 0.36
GABRG3 Q99928 2/20 0.36
GABRQ Q9UN88 2/20 0.36
ALDH1A1 P00352 7/20 0.36
KDM4E B2RXH2 3/20 0.36

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
SCHEMBL8846631 0.82 TSHR (0.45) CLCN2MRGPRX4GABRPGABRDGABRA1
SCHEMBL4973094 0.81 GABRP (0.39) CLCN2MRGPRX4GABRPGABRDGABRA1
SCHEMBL6966009 0.80 TSHR (0.44) CLCN2ALDH1A1KDM4ESMN1; SMN2MEN1
SCHEMBL20768513 0.79 MRGPRX4 (0.37) CLCN2MRGPRX4GABRPGABRDGABRA1
SCHEMBL9709811 0.79 CLCN2 (0.44) CLCN2MRGPRX4GABRPGABRDGABRA1
SCHEMBL15821394 0.79 GABRA1 (0.43) CLCN2MRGPRX4GABRPGABRDGABRA1
SCHEMBL3256019 0.79 TSHR (0.47) CLCN2MRGPRX4GABRPGABRDGABRA1
SCHEMBL1365495 0.79 CA1 (0.46) CLCN2GABRPGABRDGABRA1GABRB1
SCHEMBL6289031 0.78 SELL (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7410303 0.78 GABRP (0.37) CLCN2MRGPRX4GABRPGABRDGABRA1

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-0955294-B1 Imidazolyl-alkenoic acid SMITHKLINE BEECHAM CORP (US) 2003-09-24 EP disclosed
EP-0955294-A2 Imidazolyl-alkenoic acid SMITHKLINE BEECHAM CORPORATION (US) 1999-11-10 EP disclosed
US-5418250-A Hypotensive SMITHKLINE BEECHAM CORPORATION (US) 1995-05-23 US disclosed
US-5185351-A Hypotensive agents; for treatment of congestive heart failure, renal failure and glaucoma SMITHKLINE BEECHAM CORPORATION (US) 1993-02-09 US disclosed
EP-0403159-A2 Imidazolyl-alkenoic acids SMITHKLINE BEECHAM CORPORATION (US) 1990-12-19 EP disclosed