SCHEMBL21044400

SCHEMBL21044400

CC1=C(C(=O)O)NC(C(=O)O)=CC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.31

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
SCHEMBL18305807 0.82 NOTUM (0.31) NOTUM
SCHEMBL4574657 0.81 ALDH1A1 (0.31) —
SCHEMBL21044222 0.79 — —
SCHEMBL21044383 0.79 — —
SCHEMBL21044377 0.78 — —
SCHEMBL21044524 0.78 — —
SCHEMBL21044538 0.78 — —
SCHEMBL21044223 0.78 — —
SCHEMBL21044585 0.77 NOTUM (0.33) NOTUM
SCHEMBL21044361 0.77 — —

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
EP-3191451-B1 4-SUBSTITUTED PYRIDINE-2,6-DICARBOXYLIC ACID DERIVATIVES AND METHOD OF PREPARING SAME OKINAWA INST SCIENCE & TECH SCHOOL CORP (JP) 2019-06-05 — — EP claimed
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