SCHEMBL32689464

SCHEMBL32689464

COc1ccnc(N)c1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
KDM4C Q9H3R0 1/20 0.44
IKBKB O14920 1/20 0.43
ALDH1A1 P00352 3/20 0.42
NAPRT Q6XQN6 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 2/20 0.39
KMO O15229 2/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 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
SCHEMBL17490709 0.86 IKBKB (0.50) CA12CA1CA2CA7CA9
SCHEMBL31214504 0.84 IKBKB (0.42) CA12CA1CA2CA7CA9
SCHEMBL11816464 0.83 IKBKB (0.46) CA12CA1CA2CA9CA14
SCHEMBL7042463 0.81 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL9082035 0.80 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL10762448 0.80 CA1 (0.55) CA12CA1CA2CA7CA9
SCHEMBL16684814 0.79 ALDH1A1 (0.47) CA12CA1CA2CA7CA9
SCHEMBL4969142 0.79 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL21905825 0.79 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL4436600 0.79 CA1 (0.53) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121717754-A Synthesis method of 2-amino-4-methoxy nicotinic acid 上海毕得医药科技股份有限公司 2026-03-24 CN disclosed
CN-121717754-A Synthesis method of 2-amino-4-methoxy nicotinic acid 上海毕得医药科技股份有限公司 2026-03-24 CN disclosed