SCHEMBL3000331

SCHEMBL3000331

CCC(C1CCCCC1)(C1CCCCC1)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
SHBG P04278 1/20 0.36
EPHX1 P07099 1/20 0.31
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30
CHRM2 P08172 1/20 0.30
CYP2D6 P10635 1/20 0.30
CHRM1 P11229 1/20 0.30
KCNH2 Q12809 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
SCHEMBL2067553 0.78 CYP1A2 (0.37) CYP1A2SHBG
SCHEMBL13183862 0.78 CYP1A2 (0.37) CYP1A2SHBG
SCHEMBL6318304 0.77 CYP1A2 (0.40) CYP1A2SHBGADH1CADH1ACHRM2
SCHEMBL10535680 0.77 CYP1A2 (0.40) CYP1A2SHBGADH1CADH1ACHRM2
SCHEMBL10779865 0.77 CYP1A2 (0.40) CYP1A2SHBGADH1CADH1ACHRM2
SCHEMBL16934235 0.74 CYP1A2 (0.39) CYP1A2SHBG
SCHEMBL1396813 0.74 ALDH1A1 (0.39) CYP1A2SHBG
SCHEMBL14553280 0.74 CYP1A2 (0.39) CYP1A2SHBGCHRM2CYP2D6CHRM1
SCHEMBL28157000 0.74 CYP1A2 (0.39) CYP1A2SHBG
SCHEMBL8498087 0.74 CYP1A2 (0.44) CYP1A2SHBG

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 8 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
US-8230986-B2 Torque limiter JTEKT CORPORATION (JP) 2012-07-31 US disclosed
US-8220609-B2 Torque limiter JTEKT CORPORATION (JP) 2012-07-17 US disclosed
US-20100184519-A1 TORQUE LIMITER JTEKT CORPORATION (JP) 2010-07-22 US disclosed
US-20090173591-A1 TORQUE LIMITER JTEKT CORPORATION (JP) 2009-07-09 US 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