SCHEMBL9633022

SCHEMBL9633022

CC1=C(\O)CCCCCC/C=C\C=C\1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 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
SCHEMBL9633031 1.00 ALDH1A1 (0.30) ALDH1A1
SCHEMBL9633012 1.00 ALDH1A1 (0.30) ALDH1A1
SCHEMBL4313395 0.80 ALDH1A1 (0.32) ALDH1A1
SCHEMBL4313382 0.80 ALDH1A1 (0.32) ALDH1A1
SCHEMBL4313390 0.80 ALDH1A1 (0.32) ALDH1A1
SCHEMBL28774478 0.78 ALDH1A1 (0.33) ALDH1A1
SCHEMBL11576042 0.76
SCHEMBL30091082 0.73 ALDH1A1 (0.34) ALDH1A1
SCHEMBL11084269 0.71 ALDH1A1 (0.56) ALDH1A1
SCHEMBL18691951 0.71 ALDH1A1 (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0302993-B1 METHYLCYCLODODECATRIEN-1-OLS, METHOD FOR THEIR PRODUCTION AND THEIR APPLICATION HAARMANN & REIMER GMBH (DE) 1992-05-06 EP disclosed
EP-0302993-A1 Methylcyclododecatrien-1-ols, method for their production and their application HAARMANN & REIMER GMBH (DE) 1989-02-15 EP disclosed