SCHEMBL31633618

SCHEMBL31633618

Cc1cc(C(=O)O)c(C(=O)O)c(C)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MAPK1 P28482 1/20 0.50
LCK P06239 1/20 0.45
KDM4E B2RXH2 5/20 0.44
HPGD P15428 3/20 0.44
HSD17B10 Q99714 2/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 2/20 0.43
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
GABRA4 P48169 1/20 0.41

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
SCHEMBL8874266 1.00 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2MAPK1LCKKDM4E
SCHEMBL29953589 0.88 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2MAPK1LCKKDM4E
SCHEMBL2804478 0.82 ALOX15 (0.43) ALDH1A1SMN1; SMN2MAPK1KDM4EHPGD
SCHEMBL29415461 0.82 ALOX15 (0.43) ALDH1A1SMN1; SMN2MAPK1KDM4EHPGD
SCHEMBL7788152 0.81 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2MAPK1KDM4EHPGD
SCHEMBL13590587 0.81 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2MAPK1LCKKDM4E
SCHEMBL31125623 0.81 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2MAPK1KDM4EHPGD
SCHEMBL30445764 0.80 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPK1LCKKDM4E
SCHEMBL2805705 0.80 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPK1LCKKDM4E
SCHEMBL3559208 0.79 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2MAPK1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120192327-A Preparation method of pyridine dicarboxylic anhydride solution 张家港市国泰华荣化工新材料有限公司 2025-06-24 CN disclosed