SCHEMBL29616294

SCHEMBL29616294

CCn1ccc(C)c1C=O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ LPO P22079 2/20 0.30

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
SCHEMBL28802534 0.84 ALDH1A1 (0.37) ALDH1A1
SCHEMBL31419445 0.79 CA1 (0.33) —
SCHEMBL29955121 0.78 PTGER4 (0.33) ALDH1A1
SCHEMBL257509 0.72 — —
SCHEMBL31376015 0.65 PTGER4 (0.36) ALDH1A1TSHR
SCHEMBL859971 0.65 ADORA2A (0.35) ALDH1A1
SCHEMBL5403668 0.64 — —
SCHEMBL28241979 0.64 NQO1 (0.37) ALDH1A1TSHRLPO
SCHEMBL31727256 0.62 KDM4E (0.46) ALDH1A1
SCHEMBL29952493 0.62 — —

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-3999064-A1 INHIBITORS OF TYROSINE KINASE Bridgene Biosciences, Inc. (US) 2022-05-25 — — EP disclosed
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