SCHEMBL4657482

SCHEMBL4657482

O=C(CC(=O)OC1CC2CCC1C2)OC1CC2CCC1C2

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.56
ATM Q13315 1/20 0.54
POLB P06746 1/20 0.43
GRM1 Q13255 6/20 0.43
EPHX2 P34913 3/20 0.40
EPHX1 P07099 1/20 0.39
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
CTSV O60911 1/20 0.36
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 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
SCHEMBL2625630 0.91 ATM (0.54) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL32688877 0.88 CYP19A1 (0.48) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL32689190 0.88 EPHX2 (0.52) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL2995532 0.88 CYP19A1 (0.56) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL9917017 0.86 CYP19A1 (0.59) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL32688881 0.86 CYP19A1 (0.46) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL3073477 0.85 ATM (0.59) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL8861069 0.85 CYP19A1 (0.54) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL8861066 0.85 CYP19A1 (0.54) CYP19A1ATMPOLBGRM1EPHX2
SCHEMBL26968959 0.85 CYP19A1 (0.54) CYP19A1ATMPOLBGRM1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2009304-B1 TORQUE LIMITER JTEKT CORP (JP) 2014-10-01 EP disclosed
EP-2003353-B1 TORQUE LIMITER JTEKT CORP (JP) 2014-06-04 EP disclosed
EP-2009304-A1 TORQUE LIMITER JTEKT Corporation (JP) 2008-12-31 EP disclosed
EP-2003353-A1 TORQUE LIMITER JTEKT Corporation (JP) 2008-12-17 EP disclosed
US-6797680-B2 NON-TOXIC TO HUMANS AND POSSES A NON- OFFENSIVE ODOR, WHILE ALSO BEING INEXPENSIVE TO MANUFACTURE GENERAL MOTORS CORPORATION 2004-09-28 US disclosed