SCHEMBL6661993

SCHEMBL6661993

C=CC1CCC(CC(F)(F)OCc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.40
KMT2A Q03164 1/20 0.35
MAOB P27338 4/20 0.35
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
LSS P48449 1/20 0.34
TEAD1 P28347 7/20 0.34
NAAA Q02083 1/20 0.34
BCL2A1 Q16548 1/20 0.32
TACR1 P25103 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
SCHEMBL6661983 1.00 IDO1 (0.40) IDO1KMT2AMAOBCARM1PRMT6
SCHEMBL6666722 0.88 IDO1 (0.39) IDO1KMT2AMAOBCARM1PRMT6
SCHEMBL6666715 0.88 IDO1 (0.39) IDO1KMT2AMAOBCARM1PRMT6
SCHEMBL6665219 0.87
SCHEMBL6665253 0.87 AGXT (0.33)
SCHEMBL6665225 0.87
SCHEMBL6665259 0.87 AGXT (0.33)
SCHEMBL6667879 0.86 ESR2 (0.35)
SCHEMBL6667875 0.86 ESR2 (0.35)
SCHEMBL6666065 0.85 THRB (0.36) MAOB

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