SCHEMBL29907799

SCHEMBL29907799

O=C=NCC1CCC(C2CCCCC2)(C2CCCCC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL29220069 0.81
SCHEMBL268784 0.80 ALDH1A1 (0.42) ALDH1A1
SCHEMBL2891590 0.78
SCHEMBL21239945 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL48238 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL3692469 0.74
SCHEMBL175176 0.73
SCHEMBL1081546 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1590056 0.73
SCHEMBL44332 0.73 ALDH1A1 (0.31) ALDH1A1

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
CN-109689748-B Multi-layer composite article comprising polyurethane layer and PC/ABS layer 盛禧奥欧洲有限责任公司 2022-10-28 CN disclosed