SCHEMBL9308560

SCHEMBL9308560

CCN(/C=C/C(C)=O)CC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 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
SCHEMBL8640466 1.00 ALDH1A1 (0.32) ALDH1A1TDP1
SCHEMBL9237665 0.80 CA12 (0.34) ALDH1A1
SCHEMBL11144144 0.79 TSHR (0.40) ALDH1A1TDP1
SCHEMBL322855 0.79 TSHR (0.40) ALDH1A1TDP1
SCHEMBL9473743 0.77
SCHEMBL21127859 0.75 HCAR2 (0.32)
SCHEMBL6327534 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5443169 0.73 ALDH1A1 (0.38) ALDH1A1
SCHEMBL6892352 0.73 HCAR2 (0.52) ALDH1A1TDP1
SCHEMBL5443165 0.73 ALDH1A1 (0.38) 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
US-5288858-A Dyeing polyamides CIBA-GEIGY CORPORATION (US) 1994-02-22 US disclosed
US-5234467-A Disazo and monoazo dye mixtures; colorfastness; good affinity in short liquors; water solubility CIBA-GEIGY CORPORATION (US) 1993-08-10 US disclosed