SCHEMBL2386276

SCHEMBL2386276

Nc1ccc(C(CC(=O)O)CC(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABBR2 O75899 4/20 0.57
▸ GABBR1 Q9UBS5 4/20 0.57
▸ LMNA P02545 2/20 0.56
▸ CYP2C9 P11712 2/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ ADORA3 P0DMS8 1/20 0.56
▸ NFKB1 P19838 1/20 0.56
▸ DRD3 P35462 1/20 0.56
▸ BLM P54132 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ TSHR P16473 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ MAPT P10636 2/20 0.46

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
SCHEMBL16249736 0.89 GABBR2 (0.61) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL5701034 0.83 ALDH1A1 (0.58) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL7104404 0.81 SMN1; SMN2 (0.54) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL4600777 0.81 POLB (0.54) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL2303463 0.81 SMN1; SMN2 (0.54) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL11229344 0.80 GABBR2 (0.53) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL5700968 0.80 GAA (0.41) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL503819 0.79 GABBR2 (0.76) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL5691981 0.79 FFAR1 (0.59) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL5691985 0.79 FFAR1 (0.59) GABBR2GABBR1LMNACYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059565-B1 MODIFIED COLORANTS WITH ALIPHATIC POLY-ACID GROUPS CABOT CORP (US) 2014-06-11 — — EP disclosed
CN-101528865-B Modified colorants with aliphatic poly-acid groups CABOT CORP 2013-01-30 — — CN disclosed
US-8021471-B2 Modified colorants with aliphatic poly-acid groups CABOT CORPORATION (US) 2011-09-20 — — US disclosed
US-8021471-B2 Modified colorants with aliphatic poly-acid groups CABOT CORPORATION (US) 2011-09-20 — — US disclosed
CN-101528865-A Modified colorants with aliphatic poly-acid groups CABOT CORP (US) 2009-09-09 — — CN disclosed
EP-2059565-A2 MODIFIED COLORANTS WITH ALIPHATIC POLY-ACID GROUPS Cabot Corporation (US) 2009-05-20 — — EP disclosed
US-20080083347-A1 Readily dispersible in liquid vehicles; stability; ink jet pigments; quality optical density on plain paper CABOT CORPORATION 2008-04-10 — — US disclosed
US-20080083347-A1 Readily dispersible in liquid vehicles; stability; ink jet pigments; quality optical density on plain paper CABOT CORPORATION 2008-04-10 — — US disclosed
WO-2008027405-A2 MODIFIED COLORANTS WITH ALIPHATIC POLY-ACID GROUPS CABOT CORPORATION (US) 2008-03-06 — — WO disclosed
EP-0768898-B1 CASCADE-POLYMER COMPLEXES AND METHODS OF PRODUCING THE SAME SCHERING AG (DE) 2003-04-09 — — EP disclosed
US-6248306-B1 MEDICAL DIAGNOSIS SCHERING AKTIENGESELLSCHAFT (DE) 2001-06-19 — — US disclosed
EP-0768898-A1 CASCADE-POLYMER COMPLEXES AND METHODS OF PRODUCING THE SAME SCHERING AKTIENGESELLSCHAFT (DE) 1997-04-23 — — EP disclosed
WO-1996001655-A1 CASCADE-POLYMER COMPLEXES AND METHODS OF PRODUCING THE SAME SCHERING AKTIENGESELLSCHAFT (DE) 1996-01-25 — — WO disclosed
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