SCHEMBL4937360

SCHEMBL4937360

Cc1ccc(C(=O)O)c(CN)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 3/20 0.39
GABRD O14764 3/20 0.39
GABRA1 P14867 3/20 0.39
GABRB1 P18505 3/20 0.39
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39
GABRA5 P31644 3/20 0.39
GABRA3 P34903 3/20 0.39
GABRA2 P47869 3/20 0.39
GABRB2 P47870 3/20 0.39
GABRA4 P48169 3/20 0.39
GABRE P78334 3/20 0.39
GABRA6 Q16445 3/20 0.39
GABRG1 Q8N1C3 3/20 0.39
GABRG3 Q99928 3/20 0.39
GABRQ Q9UN88 3/20 0.39
HAAO P46952 1/20 0.39
CYP1A2 P05177 2/20 0.38
MYC P01106 1/20 0.38
CD274 Q9NZQ7 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
SCHEMBL600023 0.85 HMGB1 (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29850850 0.84 HAAO (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7072975 0.82 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28360290 0.81 CYP1A2 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL26418105 0.79 GABRP (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4957822 0.79 GABRP (0.35) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27893912 0.78 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL2227278 0.77 ALDH1A1 (0.55) CYP1A2MYCMEN1KMT2ATDP1
SCHEMBL8025733 0.77 RARB (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL17058839 0.75 GRM1 (0.37) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701852-B2 Active energy ray curable composition, ink, composition stored container, and two-dimensional or three-dimensional image forming apparatus RICOH COMPANY, LTD. (JP) 2017-07-11 US disclosed
US-20160102216-A1 ACTIVE ENERGY RAY CURABLE COMPOSITION, INK, COMPOSITION STORED CONTAINER, AND TWO-DIMENSIONAL OR THREE-DIMENSIONAL IMAGE FORMING APPARATUS RICOH COMPANY, LTD. (JP) 2016-04-14 US disclosed
US-20080233281-A1 PROCESS FOR PRODUCING AN OPTICAL ELEMENT DAI NIPPON PRINTING CO., LTD. (JP) 2008-09-25 US disclosed
US-20050129876-A1 Composition for orientation film formation DAI NIPPON PRINTING CO., LTD. (JP) 2005-06-16 US disclosed