SCHEMBL31160045

SCHEMBL31160045

CNc1cc(C(=O)OC(C)C)cc(OC(C)C)c1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.45
▸ CA1 P00915 3/20 0.45
▸ CA2 P00918 3/20 0.45
▸ CA7 P43166 3/20 0.45
▸ CA9 Q16790 3/20 0.45
▸ CA14 Q9ULX7 3/20 0.45
▸ PRKCI P41743 2/20 0.38
▸ PRKCZ Q05513 1/20 0.38
▸ CISD2 Q8N5K1 1/20 0.38
▸ ALDH1A1 P00352 6/20 0.38
▸ MAPT P10636 5/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ EP300 Q09472 2/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ LMNA P02545 3/20 0.36

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
SCHEMBL31160113 0.79 MAPT (0.43) CA12CA1CA2CA7CA9
SCHEMBL27255559 0.77 KDM4E (0.45) CA12CA1CA2CA7CA9
SCHEMBL31160054 0.77 MAPT (0.43) CA12CA1CA2CA7CA9
SCHEMBL1457837 0.77 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL31463453 0.76 KMT2A (0.37) CA12CA1CA2CA7CA9
SCHEMBL31463454 0.76 KMT2A (0.37) CA12CA1CA2CA7CA9
SCHEMBL23971107 0.75 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL31160000 0.75 MAPT (0.40) CA12CA1CA2CA7CA9
SCHEMBL1457783 0.73 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL16369801 0.73 CA12 (0.54) 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
EP-4688144-A1 COMPOUNDS AS GLP-1R AGONISTS Terns Pharmaceuticals, Inc. (US) 2026-02-11 — — EP disclosed
WO-2024206878-A1 COMPOUNDS AS GLP-1R AGONISTS TERNS PHARMACEUTICALS, INC. (US) 2024-10-03 — — WO disclosed
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