SCHEMBL6662736

SCHEMBL6662736

CC=C[C@H]1CC[C@H](CC(F)(F)OCc2ccc(C)cc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGXT P21549 2/20 0.32
GRIN2B Q13224 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
SCHEMBL6662733 1.00 AGXT (0.32) AGXTGRIN2B
SCHEMBL6662727 1.00 AGXT (0.32) AGXTGRIN2B
SCHEMBL6660776 0.90
SCHEMBL6660779 0.90
SCHEMBL6660770 0.90
SCHEMBL6665279 0.88 ESR2 (0.34)
SCHEMBL6665283 0.88 ESR2 (0.34)
SCHEMBL6665272 0.88 ESR2 (0.34)
SCHEMBL6666410 0.88 MAOA (0.32)
SCHEMBL6666414 0.88 MAOA (0.32)

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-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed