SCHEMBL22277362

SCHEMBL22277362

C=CCCC1CCC(COC2CCC(c3ccc(-c4ccc(OCC)c(F)c4F)cc3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.33
ESR2 Q92731 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
SCHEMBL19985394 0.93 ESR2 (0.34) ESR2
SCHEMBL22277348 0.92 ESR2 (0.33) ESR2
SCHEMBL22277508 0.91 GPR119 (0.34) GPR119ESR2
SCHEMBL22277359 0.90 GPR119 (0.32) GPR119
SCHEMBL22277553 0.90 GPR119 (0.32) GPR119
SCHEMBL26209579 0.90 GPR119 (0.36) GPR119ESR2
SCHEMBL22277501 0.90 GPR119 (0.33) GPR119
SCHEMBL22277551 0.90 GPR119 (0.33) GPR119
SCHEMBL22277183 0.89 CYP2C9 (0.39) GPR119ESR2
SCHEMBL22277188 0.89 CYP2C9 (0.39) GPR119ESR2

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
US-20200239775-A1 TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-07-30 US disclosed