SCHEMBL7635700

SCHEMBL7635700

C=C1CCC([C@H](C)CC=O)C1C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.32
PTPN1 P18031 1/20 0.30

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
SCHEMBL10066232 0.69
SCHEMBL7635216 0.68
SCHEMBL7939673 0.68
SCHEMBL11233154 0.67 CA1 (0.33)
SCHEMBL4578418 0.64
SCHEMBL11457289 0.63 TRPM8 (0.58)
SCHEMBL1026314 0.62
SCHEMBL7628683 0.61
SCHEMBL25338157 0.61 SHBG (0.36)
SCHEMBL17627876 0.60

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-6410504-B1 MIXING WITH ORGANOLEPTIC FIRMENICH, SA (CH) 2002-06-25 US disclosed
EP-0916650-B1 Nitriles and aldehydes derived from 3-isopropenyl-1,2-dimethyl-1-cyclopentanol and their use in perfumery FIRMENICH & CIE (CH) 2002-01-09 EP disclosed
US-6180814-B1 COMPOUNDS WHICH POSSESS EXCELLENT STABILITY IN AGGRESSIVE MEDIA, ODOR VERY SIMILAR TO THAT OF CITRAL FIRMENICH SA (CH) 2001-01-30 US disclosed
EP-0916650-A2 Nitriles and aldehydes derived from 3-isopropenyl-1,2-dimethyl-1-cyclopentanol and their use in perfumery FIRMENICH SA (CH) 1999-05-19 EP disclosed