SCHEMBL9385691

SCHEMBL9385691

CC1=CC[C@@H](C)[C@@H](CO)C1(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL9385686 1.00 USP2 (0.31) USP2NPSR1
SCHEMBL9385696 1.00 USP2 (0.31) USP2NPSR1
SCHEMBL8569065 0.68 UGT2B7 (0.33)
SCHEMBL8572455 0.68 CCR2 (0.31)
SCHEMBL8569073 0.68 UGT2B7 (0.33)
SCHEMBL8572452 0.68 CCR2 (0.31)
SCHEMBL8572809 0.68 CCR2 (0.31)
SCHEMBL8569066 0.68 UGT2B7 (0.33)
SCHEMBL9386018 0.68 CCR2 (0.36)
SCHEMBL3420633 0.68

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-0449034-B1 Cyclic ketones, method for their preparation and their application in perfumery FIRMENICH & CIE (CH) 1994-12-28 EP disclosed
US-5118865-A CYCLIC KETONES AND THEIR USE AS PERFUMING INGREDIENTS FIRMENICH SA (CH) 1992-06-02 US disclosed
EP-0449034-A1 Cyclic ketones, method for their preparation and their application in perfumery FIRMENICH SA (CH) 1991-10-02 EP disclosed