SCHEMBL13981271

SCHEMBL13981271

O=C1Nc2ccc(Cl)cc2C(c2ccccc2)NC1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
TRPM5 Q9NZQ8 3/20 0.46
TRPM4 Q8TD43 2/20 0.46
LMNA P02545 2/20 0.44
ALB P02768 1/20 0.44
GAA P10253 1/20 0.43
MAPT P10636 3/20 0.42
TP53 P04637 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.41
SLC8B1 Q6J4K2 1/20 0.41
PGR P06401 2/20 0.41
CACNB4 O00305 1/20 0.40

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
SCHEMBL13981274 0.85 TSHR (0.52) ATMMEN1KMT2ATRPM5LMNA
SCHEMBL23721282 0.83 LMNA (0.42) ATMMEN1KMT2ALMNAALB
SCHEMBL1623970 0.83 ATM (0.46) ATMMEN1KMT2ATRPM5TRPM4
SCHEMBL7463659 0.77 BRD4 (0.51) ATMMEN1KMT2ALMNAALB
SCHEMBL1421019 0.75 ATM (0.53) ATMMEN1KMT2ATRPM5TRPM4
SCHEMBL9526645 0.72 CCKBR (0.53) MEN1KMT2A
SCHEMBL9526098 0.72 CCKBR (0.53) MEN1KMT2A
SCHEMBL8923872 0.72 ATM (0.45) ATMMEN1KMT2ALMNAALB
SCHEMBL5205016 0.71 ALDH1A1 (0.46) ATMMEN1KMT2ATRPM5TRPM4
SCHEMBL21284261 0.70 CHRM1 (0.46) ATMMEN1KMT2ATRPM5TRPM4

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
WO-2008145733-A2 NOVEL CHEMICAL COMPOUNDS, PRODUCTION THEREOF, AND USE THEREOF UNIVERSITÄT LEIPZIG (DE) 2008-12-04 WO disclosed