SCHEMBL8923258

SCHEMBL8923258

CCCCc1c(Cl)cc(C(=O)O)c(C(=O)O)c1CCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C2 P52895 1/20 0.45
AKR1C1 Q04828 1/20 0.45
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
GABRE P78334 2/20 0.40
GABRA6 Q16445 2/20 0.40
GABRG1 Q8N1C3 2/20 0.40
GABRG3 Q99928 2/20 0.40
GABRQ Q9UN88 2/20 0.40
PTPN1 P18031 1/20 0.39
KAT8 Q9H7Z6 2/20 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
SCHEMBL14989159 0.85 GABRP (0.43) AKR1C2AKR1C1GABRPGABRDGABRA1
SCHEMBL9420032 0.82 GABRP (0.41) AKR1C2AKR1C1GABRPGABRDGABRA1
SCHEMBL1121887 0.82 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4627818 0.81 GABRP (0.44) AKR1C2AKR1C1GABRPGABRDGABRA1
SCHEMBL28477751 0.81 GABRP (0.43) AKR1C2AKR1C1GABRPGABRDGABRA1
SCHEMBL13518321 0.79 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14989270 0.79 KAT8 (0.49) KAT8PPARARARBHCAR2
SCHEMBL14989313 0.79 KAT8 (0.49) KAT8PPARARARBHCAR2
SCHEMBL14989326 0.79 KAT8 (0.49) KAT8PPARARARBHCAR2
SCHEMBL14989135 0.79 KAT8 (0.49) KAT8PPARARARBHCAR2

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5688959-A MULTICOLOR DYE IMAGE AND INFRARED RADIATION ABSORBER WITH 1-HYDROXY-2-N-(5-ALKYLTHIAZOL-2-YL)NAPHTHAMIDE COUPLERS FORMING QUINONE IMINE DYES AGFA-GEVAERT, N.V. (BE) 1997-11-18 US disclosed
EP-0373573-B1 Recording material for ink jet printing CIBA GEIGY AG (CH) 1994-06-22 EP disclosed
EP-0359710-B1 OPTICAL BRIGHTENING AGENTS CIBA-GEIGY AG (CH) 1993-06-16 EP disclosed
EP-0280650-B1 USE OF PREDETERMINED BENZTRIAZOLE DERIVATIVES AS LIGHT-PROTECTING AGENTS FOR INK JET RECORDING MATERIALS CIBA-GEIGY AG (CH) 1992-04-08 EP disclosed
US-5030544-A 1-hydroxy-2-n(5-alkyl thiazol 2-yl) naphthamides, form quinone-imine dyes AGFA-GEVAERT, N.V. (BE) 1991-07-09 US disclosed
EP-0373573-A1 Recording material for ink jet printing CIBA-GEIGY AG (CH) 1990-06-20 EP disclosed
EP-0359710-A1 Optical brightening agents CIBA-GEIGY AG (CH) 1990-03-21 EP disclosed
EP-0280650-A1 Use of predetermined benztriazole derivatives as light-protecting agents for ink jet recording materials CIBA-GEIGY AG (CH) 1988-08-31 EP disclosed
EP-0176628-B1 PHOTOGRAPHIC COLOUR ELEMENTS AGFA-GEVAERT N.V. (BE) 1987-11-25 EP disclosed
EP-0084692-B1 METHOD OF DISPERSING PHOTOGRAPHIC ADJUVANTS IN A HYDROPHILIC COLLOID COMPOSITION AGFA-GEVAERT N.V. (BE) 1986-06-11 EP disclosed
EP-0176628-A1 Photographic colour elements AGFA-GEVAERT N.V. (BE) 1986-04-09 EP disclosed
US-4430422-A USING 1,3-DIALKYLOXY-2-PROPANOLS AND CARBOXYLIC, PHOSPHORIC OR PHOSPHONIC ESTERS THEREOF AGFA-GEVAERT, N.V. (BE) 1984-02-07 US disclosed
US-4430421-A USING IHYDROXYMETHYL(5,2,1,0(2,6))TRICYCLODECANE, OR CARBOXYLIC, PHOSPHORIC, OR PHOSPHONIC DIESTERS THEREOF AGFA-GEVAERT, N.V. (BE) 1984-02-07 US disclosed
EP-0084694-A1 Method of dispersing photographic adjuvants in hydrophilic colloid compositions AGFA-GEVAERT N.V. (BE) 1983-08-03 EP disclosed
EP-0084692-A2 Method of dispersing photographic adjuvants in a hydrophilic colloid composition AGFA-GEVAERT N.V. (BE) 1983-08-03 EP disclosed