SCHEMBL4955238

SCHEMBL4955238

CC=C(C)C(=O)OCC=C(C)CCC=C(C)CC

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
ALOX15 P16050 1/20 0.51
FNTA P49354 2/20 0.43
FNTB P49356 2/20 0.43
PGGT1B P53609 1/20 0.43
TRPV1 Q8NER1 2/20 0.40

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
SCHEMBL10602851 0.90 ALDH1A1 (0.39) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL10602856 0.90 ALDH1A1 (0.39) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL29165442 0.89 ALDH1A1 (0.67) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL5869130 0.89 ALDH1A1 (0.67) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL874195 0.87 ALDH1A1 (0.69) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL18604017 0.87 ALDH1A1 (0.69) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL874196 0.87 ALDH1A1 (0.69) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL1793466 0.87 ALDH1A1 (0.69) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL5596597 0.87 ALDH1A1 (0.69) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL23706455 0.83 ALDH1A1 (0.73) ALDH1A1ALOX15FNTAFNTBPGGT1B

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-20080221003-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-09-11 US disclosed
US-20080207481-A1 CONSUMER PRODUCTS HAVING VARYING ODORS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-08-28 US disclosed