SCHEMBL1108073

SCHEMBL1108073

CCCCCCCCCCCCOc1cc(SOOO)ccc1OCCOCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
PLA2G2D Q9UNK4 1/20 0.34
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32
S1PR1 P21453 2/20 0.31
LMNA P02545 1/20 0.30
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL1108092 0.94 MAPT (0.39) MAPTUSP2TSHRPLA2G2DCYP1A2
SCHEMBL1108080 0.93 USP2 (0.32) MAPTUSP2TSHR
SCHEMBL9915557 0.79 SMPD1 (0.42) MAPTS1PR1LMNATHRATHRB
SCHEMBL1108101 0.70 MAPT (0.41) MAPTUSP2TSHRCYP1A2CYP2C9
SCHEMBL1108111 0.70 MAPT (0.41) MAPTUSP2TSHRCYP1A2CYP2C9
SCHEMBL9587375 0.68 TSHR (0.40) MAPTUSP2TSHRCYP1A2CYP2C9
SCHEMBL9728727 0.66 MAPT (0.40) MAPTUSP2TSHRCYP1A2CYP2C9
SCHEMBL9588956 0.65 CYP1A2 (0.40) MAPTUSP2TSHRCYP1A2CYP2C9
SCHEMBL14565990 0.65 THRB (0.40) MAPTUSP2PLA2G2DLMNATHRA
SCHEMBL14340948 0.63 NAAA (0.34) MAPTUSP2TSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153246-B2 Optical compensatory film, polarizing plate, and liquid crystal display device FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-7658864-B2 Liquid crystal composition, optical compensation film and liquid crystal display device FUJIFILM CORPORATION (JP) 2010-02-09 US disclosed
US-20090273740-A1 OPTICAL COMPENSATORY FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2009-11-05 US disclosed
US-20090009693-A1 Liquid Crystal Composition, Optical Compensation Film and Liquid Crystal Display Device FUJIFILM CORPORATION (JP) 2009-01-08 US disclosed