SCHEMBL11374136

SCHEMBL11374136

C=CCCC(=O)C1=C[C@H](C)[C@@H](C)CC1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 5/20 0.35
▸ CES2 O00748 2/20 0.32
▸ MGLL Q99685 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
SCHEMBL11378352 1.00 FAAH (0.35) FAAHCES2MGLL
SCHEMBL11374140 1.00 FAAH (0.35) FAAHCES2MGLL
SCHEMBL8163844 0.74 FAAH (0.30) FAAH
SCHEMBL7023693 0.74 FAAH (0.30) FAAH
SCHEMBL7021558 0.73 FAAH (0.32) FAAH
SCHEMBL9468314 0.71 CES2 (0.47) CES2
SCHEMBL11369859 0.71 FAAH (0.33) FAAH
SCHEMBL11370649 0.71 FAAH (0.33) FAAH
SCHEMBL11376456 0.71 FAAH (0.33) FAAH
SCHEMBL11369858 0.71 FAAH (0.33) FAAH

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4147672-A Cyclic C6 ketones in perfumes FIRMENICH SA (CH) 1979-04-03 — — US claimed
US-4289659-A CYCLOHEXANE DERIVATIVES FIRMENICH SA (CH) 1981-09-15 — — US disclosed
US-4264467-A Cyclic C6 compounds and their use in perfumes FIRMENICH SA (CH) 1981-04-28 — — US disclosed
US-4147672-A Cyclic C6 ketones in perfumes FIRMENICH SA (CH) 1979-04-03 — — US disclosed
Send feedback