SCHEMBL10302845

SCHEMBL10302845

CCCC(O)c1ccc(OCc2ccc(-c3ccc(OCC)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.35
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ GAA P10253 3/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ ADRA1D P25100 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ ADRA1B P35368 1/20 0.33
▸ POLB P06746 2/20 0.32
▸ MITF O75030 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TACR2 P21452 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
SCHEMBL10303161 0.93 FFAR4 (0.33) FFAR4MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL12821312 0.91 KMT2A (0.37) FFAR4MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL12822822 0.91 KMT2A (0.37) FFAR4MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL10303090 0.89 CNR2 (0.34) FFAR4MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL10303057 0.89 GABRA1 (0.33) FFAR4MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL10303119 0.88 ABCB1 (0.38) FFAR4MAPTGAAPOLBTP53
SCHEMBL12907051 0.87 FPR2 (0.32) FFAR4MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL10303118 0.87 FFAR1 (0.40) FFAR4MAPTKDM4ENPC1ALDH1A1
SCHEMBL10303134 0.87 FFAR1 (0.40) MAPTKDM4EMAPK1
SCHEMBL10302880 0.86 MAPT (0.39) FFAR4MAPTSMN1; SMN2RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8216489-B2 Three-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-07-10 — — US disclosed
EP-2266941-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE Chisso Corporation (JP) 2010-12-29 — — EP disclosed
WO-2009125668-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE チッソ株式会社 (JP) 2009-10-15 — — WO disclosed
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