SCHEMBL7916080

SCHEMBL7916080

CCCCC1CCC(c2ccc(-c3ccc(C4CCC(CCCCF)CC4)cc3)cc2F)CC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 12/20 0.38
CYP2C9 P11712 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
DGAT1 O75907 2/20 0.35
ESR2 Q92731 1/20 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
SCHEMBL7902490 1.00 OPRL1 (0.38) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL7916076 1.00 OPRL1 (0.38) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL7902486 1.00 OPRL1 (0.38) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL7912355 0.99 OPRL1 (0.37) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL7912358 0.99 OPRL1 (0.37) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL17175202 0.93 OPRL1 (0.41) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL7909662 0.92 CYP2C9 (0.42) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL7909656 0.92 CYP2C9 (0.42) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL16258047 0.92 CYP2C9 (0.44) OPRL1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL17897886 0.92 CYP2C9 (0.44) OPRL1CYP2C9ALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6174456-B1 STABILITY, LOW VISCOSITY AND HIGH TRANSITION TEMPERATURE OF THE ISOTROPIC PHASE CHISSO CORPORATION (JP) 2001-01-16 US disclosed
EP-0857708-A1 LIQUID CRYSTAL COMPOUNDS HAVING SUBSTITUTED ALKYL GROUPS, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1998-08-12 EP disclosed