SCHEMBL2271173

SCHEMBL2271173

c1ccc2cc(C(OC(c3ccc4ccccc4c3)C3CO3)C3CO3)ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.48
SLC6A2 P23975 6/20 0.48
SLC6A4 P31645 6/20 0.48
KCNH2 Q12809 4/20 0.48
UGT2B7 P16662 1/20 0.42
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
AOC3 Q16853 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
REN P00797 2/20 0.35

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
SCHEMBL3687682 0.77 IDO1 (0.44) SLC6A3SLC6A2SLC6A4
SCHEMBL151181 0.77 IDO1 (0.44) SLC6A3SLC6A2SLC6A4
SCHEMBL28337642 0.77 UGT2B7 (0.52) SLC6A3SLC6A2SLC6A4KCNH2UGT2B7
SCHEMBL28337645 0.77 UGT2B7 (0.52) SLC6A3SLC6A2SLC6A4KCNH2UGT2B7
SCHEMBL7867600 0.75 EPHX1 (0.41)
SCHEMBL9420774 0.72 SLC6A2 (0.41) SLC6A3SLC6A2SLC6A4AOC3
SCHEMBL8924148 0.72 HSD17B2 (0.38) SLC6A3SLC6A2SLC6A4AOC3
SCHEMBL333671 0.71 CA12 (0.41) MEN1KMT2ACYP1A2
SCHEMBL8847061 0.71 MGLL (0.42) SLC6A3SLC6A2SLC6A4
SCHEMBL7235653 0.71 IDO1 (0.38) SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0605937-B1 Antistatic resin composition DAISO CO LTD (JP) 1997-06-11 EP claimed
US-5476917-A Dispersity of pigments; gloss KOREA CHEMICAL CO., LTD. (KR) 1995-12-19 US claimed
US-8008405-B2 Passivating coating polymer having a nitro group, a pyridine group and/or a phenolic hydroxyl group; and a phosphorus-containing group and/or a carboxylic acid group; combined corrosion or hydrolysis inhibitor and surface modifier for flake pigment; decorative automobile finishes PPG INDUSTRIES OHIO, INC. (US) 2011-08-30 US disclosed
US-20080306241-A1 METHOD OF STABILIZING METAL PIGMENTS AGAINST GASSING PPG INDUSTRIES OHIO, INC. (US) 2008-12-11 US disclosed
US-7462394-B2 Method of stabilizing metal pigments against gassing PPG INDUSTRIES OHIO, INC. (US) 2008-12-09 US disclosed
EP-1877497-A1 METHOD OF STABILIZING METAL PIGMENTS AGAINST GASSING PPG Industries Ohio, Inc. (US) 2008-01-16 EP disclosed
WO-2006118577-A1 METHOD OF STABILIZING METAL PIGMENTS AGAINST GASSING PPG INDUSTRIES OHIO, INC. (US) 2006-11-09 WO disclosed
US-20050250877-A1 Method of stabilizing metal pigments against gassing PPG INDUSTRIES OHIO, INC. 2005-11-10 US disclosed
EP-0391230-B1 Reaction products of alpha-aminoethylene phosphonic acids and epoxy compounds and their use in coating compositions PPG INDUSTRIES INC (US) 1996-06-05 EP disclosed
US-5476917-A Dispersity of pigments; gloss KOREA CHEMICAL CO., LTD. (KR) 1995-12-19 US disclosed
EP-0170474-B1 WATER-BORNE COATING COMPOSITIONS CONTAINING METALLIC PIGMENT HAVING REDUCED TENDENCY TO GAS GENERATION ON STORAGE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-09 EP disclosed
US-5091451-A Prevention of pigment reacting with water to release gas; colorfastness; antiaglomerants; acrylic lacquers PPG INDUSTRIES, INC. (US) 1992-02-25 US disclosed
US-5034556-A Powder coating composition curing a polyepoxide with an aminomethylenephosphonic acid PPG INDUSTRIES, INC. (US) 1991-07-23 US disclosed
EP-0391230-A2 Reaction products of alpha-aminoethylene phosphonic acids and epoxy compounds and their use in coating compositions PPG INDUSTRIES, INC. (US) 1990-10-10 EP disclosed
US-4621112-A PHOSPHATE GASSING INHIBITOR IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-11-04 US disclosed
EP-0170474-A2 Water-borne coating compositions containing metallic pigment having reduced tendency to gas generation on storage IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-02-05 EP disclosed