SCHEMBL8732173

SCHEMBL8732173

CC=Cc1ccc(-c2ccc(-c3ccc(COCC=CCC)cc3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX5 P09917 1/20 0.35
IDO1 P14902 2/20 0.32
AGXT P21549 2/20 0.32
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPN11 Q06124 1/20 0.31
ABCB1 P08183 1/20 0.31
TK1 P04183 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 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
SCHEMBL8732171 1.00 LMNA (0.36) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8725496 1.00 LMNA (0.36) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8725504 1.00 LMNA (0.36) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8727628 0.89 LMNA (0.39) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8725284 0.89 LMNA (0.39) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8727620 0.89 LMNA (0.39) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8725288 0.89 LMNA (0.39) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8728012 0.84 SPHK1 (0.35) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8728021 0.84 SPHK1 (0.35) LMNATP53CYP3A4TSHRKDM4E
SCHEMBL8728024 0.84 SPHK1 (0.35) LMNATP53CYP3A4TSHRKDM4E

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-0882695-A1 BENZYL ETHER DERIVATIVES, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1998-12-09 EP disclosed