SCHEMBL7733193

SCHEMBL7733193

CCCCc1ccc(C(F)(F)Oc2ccc(COc3c(F)c(F)c(F)c(F)c3F)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 4/20 0.40
▸ MAOB P27338 5/20 0.39
▸ HRH3 Q9Y5N1 2/20 0.38
▸ ALOX5 P09917 3/20 0.36
▸ PTGES O14684 2/20 0.36
▸ BCHE P06276 1/20 0.35
▸ PTPRC P08575 1/20 0.35
▸ PTPN2 P17706 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ PTPRB P23467 1/20 0.35
▸ PTPN6 P29350 1/20 0.35
▸ CDC25A P30304 1/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ SMPD1 P17405 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP6 Q9GZR1 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
SCHEMBL7729685 0.87 MAOB (0.39) MAOBPTPRCPTPN2PTPN1PTPRB
SCHEMBL7732798 0.85 CA2 (0.41) PSEN1
SCHEMBL7731366 0.82 FAAH (0.39) PSEN1
SCHEMBL7731911 0.82 FAAH (0.45) —
SCHEMBL7735066 0.81 FAAH (0.48) —
SCHEMBL7722561 0.81 FAAH (0.48) —
SCHEMBL7722899 0.81 PSEN1 (0.43) PSEN1MAOBALOX5PTGESPPARG
SCHEMBL7731048 0.81 FAAH (0.48) —
SCHEMBL7732506 0.81 HDAC3 (0.45) ALOX5PPARG
SCHEMBL7733465 0.81 FAAH (0.48) —

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-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 — — EP disclosed
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