SCHEMBL8529793

SCHEMBL8529793

O=CC=CC=CN1CCCC1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL8529790 1.00 ALDH1A1 (0.35) ALDH1A1
SCHEMBL8531017 0.97 ALDH1A1 (0.33) ALDH1A1
SCHEMBL8531022 0.97 ALDH1A1 (0.33) ALDH1A1
SCHEMBL20752398 0.88
SCHEMBL644462 0.88
SCHEMBL3541272 0.86 HSD17B10 (0.31)
SCHEMBL448720 0.86 HSD17B10 (0.31)
SCHEMBL8532924 0.80 RECQL (0.46) ALDH1A1
SCHEMBL8530051 0.80 RECQL (0.46) ALDH1A1
SCHEMBL8532927 0.80 RECQL (0.46) 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-0873746-A2 Dyestuff for keratinous fibers Henkel Kommanditgesellschaft auf Aktien (DE) 1998-10-28 EP claimed
EP-0873746-A2 Dyestuff for keratinous fibers Henkel Kommanditgesellschaft auf Aktien (DE) 1998-10-28 EP disclosed