SCHEMBL9245702

SCHEMBL9245702

CC1=CC(=O)C2C(C)(C)CCCC2(C)C1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.37
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL9246179 1.00 EP300 (0.37) EP300USP2ALDH1A1CYP3A4MAPT
SCHEMBL9240399 1.00 EP300 (0.37) EP300USP2ALDH1A1CYP3A4MAPT
SCHEMBL11447483 0.71 EP300 (0.48) EP300USP2ALDH1A1CYP3A4MAPT
SCHEMBL16010773 0.71 EP300 (0.48) EP300USP2ALDH1A1CYP3A4MAPT
SCHEMBL14881442 0.71 EP300 (0.48) EP300USP2ALDH1A1CYP3A4MAPT
SCHEMBL9241904 0.70 EP300 (0.33) EP300
SCHEMBL9242530 0.70 EP300 (0.33) EP300
SCHEMBL9242527 0.70 EP300 (0.33) EP300
SCHEMBL16010973 0.68 EP300 (0.45) EP300USP2ALDH1A1CYP3A4MAPT
SCHEMBL19599271 0.66 NR3C1 (0.33)

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-0465936-B1 Decalinylketones, their use in perfumery and process for their preparation FIRMENICH & CIE (CH) 1995-01-25 EP claimed
US-5114915-A Amber-woody odor; cosmetics FIRMENICH SA (CH) 1992-05-19 US claimed
US-5114915-A Amber-woody odor; cosmetics FIRMENICH SA (CH) 1992-05-19 US disclosed