SCHEMBL9315436

SCHEMBL9315436

Cc1nc(C(=O)O)c(C(=O)O)cc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 3/20 0.50
GABRP O00591 2/20 0.47
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRG2 P18507 2/20 0.47
GABRB3 P28472 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
GABRE P78334 2/20 0.47
GABRA6 Q16445 2/20 0.47
GABRG1 Q8N1C3 2/20 0.47
GABRG3 Q99928 2/20 0.47
GABRQ Q9UN88 2/20 0.47

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
SCHEMBL70795 0.86 SMN1; SMN2 (0.65) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL11655924 0.85 ALDH1A1 (0.49) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL8658096 0.85 KDM4E (0.41) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL9491457 0.84 SMN1; SMN2 (0.62) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL258457 0.84 ALDH1A1 (0.43) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL10465634 0.83 GABRP (0.44) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL2807041 0.82 GABRP (0.47) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL9077344 0.82 SORT1 (0.44) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL29110843 0.81 ALDH1A1 (0.41) SMN1; SMN2MEN1KMT2AALDH1A1GABRP
SCHEMBL30660932 0.81 ALDH1A1 (0.41) SMN1; SMN2MEN1KMT2AALDH1A1GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107868041-A 6-methyl-2, 3, 5-pyridine tricarboxylic acid and synthesis method thereof 中山市得高行知识产权中心(有限合伙) 2018-04-03 CN claimed
CN-107868041-A 6-methyl-2, 3, 5-pyridine tricarboxylic acid and synthesis method thereof 中山市得高行知识产权中心(有限合伙) 2018-04-03 CN disclosed
CN-102070517-B 6-methyl-2,3,5-pyridine tricarboxylic acid and synthetic method thereof UNIV TIANJIN 2012-01-04 CN disclosed
CN-102070517-B 6-methyl-2,3,5-pyridine tricarboxylic acid and synthetic method thereof UNIV TIANJIN 2012-01-04 CN disclosed
CN-102070517-B 6-methyl-2,3,5-pyridine tricarboxylic acid and synthetic method thereof UNIV TIANJIN 2012-01-04 CN disclosed
CN-102070517-A 6-methyl-2,3,5-pyridine tricarboxylic acid and synthetic method thereof UNIV TIANJIN 2011-05-25 CN disclosed
CN-102070517-A 6-methyl-2,3,5-pyridine tricarboxylic acid and synthetic method thereof UNIV TIANJIN 2011-05-25 CN disclosed
CN-102070517-A 6-methyl-2,3,5-pyridine tricarboxylic acid and synthetic method thereof UNIV TIANJIN 2011-05-25 CN disclosed
US-5334576-A Pre- and postemergence AMERICAN CYANAMID COMPANY (US) 1994-08-02 US disclosed
EP-0322616-A2 Novel 5(and/or 6)substituted 2-(2-imidazolin-2-yl)nicotinic acids, esters and salts, useful as herbicidal agents and nivel intermediates for the preparation of said nicotinic acids, esters and salts AMERICAN CYANAMID COMPANY (US) 1989-07-05 EP disclosed