SCHEMBL25128201

SCHEMBL25128201

CCc1scc(C(C)C)c1C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.34

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
SCHEMBL20209764 0.77 ELANE (0.33) ELANE
SCHEMBL25128692 0.77 GABRA1 (0.37) ELANE
SCHEMBL12456227 0.72 CYP1A2 (0.35)
SCHEMBL8076908 0.72
SCHEMBL22789086 0.70 TKT (0.32)
SCHEMBL21479557 0.68
SCHEMBL12263141 0.68 GABRA1 (0.33)
SCHEMBL21737591 0.68
SCHEMBL13626136 0.67 ALDH1A1 (0.33)
SCHEMBL17020332 0.65 ALOX5 (0.33)

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
WO-2023040793-A1 ANTI-INFLAMMATORY COMPOUND AND USE THEREOF 映恩生物制药(苏州)有限公司 2023-03-23 WO disclosed