SCHEMBL8216707

SCHEMBL8216707

CCCOCC1CCC(c2ccc(-c3ccc(C4CCC(CCC)CC4)c(F)c3)cc2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 16/20 0.42
DGAT1 O75907 1/20 0.36
FFAR4 Q5NUL3 2/20 0.35
GPR119 Q8TDV5 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
SCHEMBL8207474 0.94 CYP2C9 (0.40) OPRL1DGAT1FFAR4
SCHEMBL8207233 0.88 OPRL1 (0.36) OPRL1DGAT1FFAR4
SCHEMBL8208485 0.87 OPRL1 (0.43) OPRL1DGAT1FFAR4GPR119
SCHEMBL8216625 0.87 OPRL1 (0.37) OPRL1DGAT1
SCHEMBL7861027 0.84 OPRL1 (0.39) OPRL1DGAT1FFAR4
SCHEMBL7861031 0.84 OPRL1 (0.39) OPRL1DGAT1FFAR4
SCHEMBL8931253 0.83 OPRL1 (0.50) OPRL1DGAT1
SCHEMBL8931254 0.83 OPRL1 (0.50) OPRL1DGAT1
SCHEMBL8267397 0.82 OPRL1 (0.41) OPRL1DGAT1FFAR4
SCHEMBL8216711 0.82 OPRL1 (0.41) OPRL1DGAT1FFAR4GPR119

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-6117361-A FOUR RING COMPOUND HAVING AN ALKYL GROUP SUBSTITUTED WITH ONE OR MORE ETHERS, AND A HALOGEN ATOM SUBSTITUTED BENZENE RING; BROAD TEMPERATURE RANGE OF NEMATIC PHASE, HIGHER MISCIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS, AND CHEMICAL STABILITY CHISSO CORP. (JP) 2000-09-12 US disclosed
EP-0891961-A1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED 1,4-PHENYLENE SKELETONS, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORPORATION (JP) 1999-01-20 EP disclosed