SCHEMBL13067348

SCHEMBL13067348

CCC(O)c1ccc(OC(=O)c2ccc(-c3ccc(C4CO4)c(F)c3C(F)F)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
PRSS1 P07477 1/20 0.30
ACR P10323 1/20 0.30
APP P05067 2/20 0.30
ESR1 P03372 1/20 0.30
HIF1A Q16665 1/20 0.30
TP53 P04637 1/20 0.30
CYP2C19 P33261 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
SCHEMBL13067346 0.86 MAPT (0.41) MAPTKMT2AMEN1PRSS1ACR
SCHEMBL12822564 0.78 MAPT (0.33) MAPTKMT2AMEN1APPHIF1A
SCHEMBL12823900 0.78 APP (0.32) MAPTAPPCYP2C19
SCHEMBL9906005 0.77 ESR1 (0.40) MAPTGAAKMT2AMEN1PRSS1
SCHEMBL12717495 0.75 ALOX5AP (0.33) MAPT
SCHEMBL13586617 0.75 PTPN7 (0.30)
SCHEMBL13066971 0.75 SCN1A (0.33) MAPTCYP2C19
SCHEMBL12822944 0.75 ALOX5AP (0.33) MAPT
SCHEMBL15343568 0.74 FASN (0.35)
SCHEMBL13066969 0.74 F2 (0.33) KMT2A

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
US-7838087-B2 Benzene derivative, liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2010-11-23 US disclosed