SCHEMBL6547360

SCHEMBL6547360

CCCCCC1=CCC(C)(c2ccccc2)C=C1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 2/20 0.35
OPRM1 P35372 6/20 0.34
OPRL1 P41146 5/20 0.34
OPRD1 P41143 3/20 0.34
OPRK1 P41145 3/20 0.34
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
KCNH2 Q12809 1/20 0.33
LPL P06858 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
SCHEMBL6546828 0.97 OPRM1 (0.34) OPRM1OPRL1OPRD1OPRK1MMP2
SCHEMBL28933169 0.77 OPRM1 (0.35) LIPGOPRM1OPRL1OPRD1OPRK1
SCHEMBL28933186 0.76 OPRM1 (0.34) LIPGOPRM1OPRL1OPRD1OPRK1
SCHEMBL15541295 0.72 CYP19A1 (0.33) LIPGLPL
SCHEMBL6037214 0.72 OPRM1 (0.32) OPRM1OPRL1OPRK1
SCHEMBL11960123 0.71 LIPG (0.32) LIPGKCNH2LPL
SCHEMBL27656430 0.70 BACE1 (0.33) OPRM1OPRL1OPRK1KCNH2
SCHEMBL28999759 0.70 OPRM1 (0.34) LIPGOPRM1OPRL1OPRD1OPRK1
SCHEMBL10875599 0.69 LIPG (0.36) LIPGLPL
SCHEMBL22206929 0.69 KDM4E (0.32) OPRM1OPRL1OPRK1

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
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed