SCHEMBL6662034

SCHEMBL6662034

CCc1ccc(COC(F)(F)Cc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.50
MAOB P27338 7/20 0.46
KMT2A Q03164 1/20 0.44
PTPN1 P18031 1/20 0.42
TAAR1 Q96RJ0 1/20 0.39
MMP12 P39900 2/20 0.38
MMP1 P03956 1/20 0.38
MAPT P10636 1/20 0.36
FFAR1 O14842 2/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL6660767 0.87 IDO1 (0.47) IDO1MAOBKMT2APTPN1TAAR1
SCHEMBL6667004 0.84 LMNA (0.47) IDO1MAOBKMT2APTPN1MAPT
SCHEMBL6661860 0.83 ESR1 (0.44) IDO1MAOBTAAR1
SCHEMBL6666035 0.83 TAAR1 (0.38) PTPN1TAAR1MAPT
SCHEMBL6664949 0.81 TSHR (0.45) MAPT
SCHEMBL91061 0.81 TAAR1 (0.54) IDO1MAOBKMT2ATAAR1MAPT
Ammonia Solution, Strong SCHEMBL266277 0.79 TAAR1 (0.52) IDO1MAOBKMT2ATAAR1MAPT
SCHEMBL6661174 0.79 CYP2A6 (0.59) MAOBKMT2A
SCHEMBL6666978 0.79 FAAH (0.48)
SCHEMBL6662935 0.78 LMNA (0.39) PTPN1MAPTPPARG

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