SCHEMBL10696955

SCHEMBL10696955

CCCCCCCCCCCCC(CC)C(C)OC(C)C(CC)CCCCCCCCCCCC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.41
SPHK1 Q9NYA1 1/20 0.39
LMNA P02545 1/20 0.38
DNM1 Q05193 2/20 0.37
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
SMPD1 P17405 3/20 0.35
ACE2 Q9BYF1 1/20 0.35
GPR84 Q9NQS5 2/20 0.34
FDPS P14324 2/20 0.34

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
SCHEMBL11699302 1.00 OPRM1 (0.41) OPRM1SPHK1LMNADNM1ADH1B
SCHEMBL9774478 0.91 ALDH1A1 (0.36) OPRM1LMNADNM1TSHRFDPS
Ethylene Glycol SCHEMBL22499766 0.83 ALDH1A1 (0.40) LMNATSHR
SCHEMBL3481742 0.80 OPRM1 (0.39) OPRM1SPHK1LMNADNM1ADH1B
SCHEMBL28846487 0.80 TSHR (0.50) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL28399942 0.80 TSHR (0.50) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL28264637 0.80 TSHR (0.50) OPRM1SPHK1LMNADNM1TSHR
Propylene Glycol SCHEMBL22499608 0.79 ALDH1A1 (0.42) SPHK1LMNATSHR
SCHEMBL5186423 0.78 OPRM1 (0.38) OPRM1SPHK1LMNADNM1ADH1B
SCHEMBL11491167 0.78 OPRM1 (0.46) OPRM1SPHK1LMNADNM1ADH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0278384-A2 Alcohols and ethers with cyclododecyl and cyclododecenyl groups, their preparation and use as parfuming agents Consortium für elektrochemische Industrie GmbH (DE) 1988-08-17 EP disclosed