SCHEMBL7017455

SCHEMBL7017455

Cc1ncc(CC(=O)O)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.52
GABRD O14764 2/20 0.52
GABRA1 P14867 2/20 0.52
GABRB1 P18505 2/20 0.52
GABRG2 P18507 2/20 0.52
GABRB3 P28472 2/20 0.52
GABRA5 P31644 2/20 0.52
GABRA3 P34903 2/20 0.52
GABRA2 P47869 2/20 0.52
GABRB2 P47870 2/20 0.52
GABRA4 P48169 2/20 0.52
GABRE P78334 2/20 0.52
GABRA6 Q16445 2/20 0.52
GABRG1 Q8N1C3 2/20 0.52
GABRG3 Q99928 2/20 0.52
GABRQ Q9UN88 2/20 0.52
P4HTM Q9NXG6 1/20 0.52
AKR1B1 P15121 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
AGBL2 Q5U5Z8 2/20 0.43

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
SCHEMBL2760902 0.80 HTT (0.44) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7499590 0.79 GABRA1 (0.53) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7468895 0.78 P4HTM (0.55) P4HTMLMNA
SCHEMBL12304432 0.78 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23286878 0.77 GABRA1 (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1808424 0.77 GABRP (0.31) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL2334583 0.77 GABRA5 (0.62) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1404488 0.77 GABRA1 (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL575044 0.77 GABRP (0.61) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21874280 0.77 GABRP (0.47) GABRPGABRDGABRA1GABRB1GABRG2

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
WO-2003106435-A1 FUSED-RING PYRIMIDIN-4(3H)-ONE DERIVATIVES, PROCESSES FOR THE PREPARATION AND USES THEREOF SANKYO COMPANY, LIMITED (JP) 2003-12-24 WO disclosed
EP-0139090-B1 PROCESS FOR THE PRE-TREATMENT OF POLYIMIDES SCHERING AKTIENGESELLSCHAFT (DE) 1988-07-27 EP disclosed
US-4517254-A ALKALI METAL HYDROXIDE, AMINOALKYLPOLYACID COMPOUNT SCHERING AKTIENGESELLSCHAFT (DE) 1985-05-14 US disclosed
EP-0139090-A1 Process for the pre-treatment of polyimides SCHERING AKTIENGESELLSCHAFT (DE) 1985-05-02 EP disclosed
US-4248632-A ACTIVATION OF A POLYMER SURFACE WITH A PALLADIUM COMPLEX SALT SCHERING AKTIENGESELLSCHAFT (DE) 1981-02-03 US disclosed