SCHEMBL10880671

SCHEMBL10880671

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

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL10880675 1.00 ALDH1A1 (0.33) ALDH1A1TDP1
SCHEMBL11152256 0.78 ALDH1A1 (0.31) ALDH1A1TDP1
SCHEMBL11152259 0.78 ALDH1A1 (0.31) ALDH1A1TDP1
SCHEMBL17106359 0.78 MAPK1 (0.41) ALDH1A1
SCHEMBL19801517 0.75 TSHR (0.30) TDP1
SCHEMBL10878062 0.74
SCHEMBL10878058 0.74
SCHEMBL14815386 0.74 GGPS1 (0.57) ALDH1A1
Phosphonic Acid SCHEMBL11463638 0.71 MAPK1 (0.37) ALDH1A1
SCHEMBL11033434 0.71 ALDH1A1 (0.36) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0085352-B1 UNSATURATED OXIMES, PREPARATION THEREOF AND USE THEREOF AS PERFUME AND IN THE FRAGMENT COMPOSITIONS L. GIVAUDAN & CIE Société Anonyme (CH) 1986-01-22 EP disclosed
US-4544714-A PERFUMES GIVAUDAN CORPORATION (US) 1985-10-01 US disclosed
EP-0085352-A2 Unsaturated oximes, preparation thereof and use thereof as perfume and in the fragment compositions L. GIVAUDAN & CIE Société Anonyme (CH) 1983-08-10 EP disclosed