SCHEMBL11374166

SCHEMBL11374166

CCOC(=O)Cc1csc(NNC(=O)c2ccccc2)n1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.64
TP53 P04637 1/20 0.64
ALDH1A1 P00352 4/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
MAPT P10636 3/20 0.61
MAPK1 P28482 2/20 0.60
NPSR1 Q6W5P4 2/20 0.59
HTT P42858 2/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
TSHR P16473 1/20 0.57
PKM P14618 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL27751166 0.78 LMNA (0.69) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL4636133 0.77 MAPT (0.70) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL11009364 0.77 SMN1; SMN2 (0.69) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL11363579 0.77 ALDH1A1 (1.00) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL3547359 0.77 MAPT (0.80) LMNAALDH1A1CYP2C9CYP2C19MEN1
SCHEMBL676083 0.76 SMN1; SMN2 (0.64) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL15581471 0.76 LMNA (0.54) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL2753912 0.76 LMNA (0.69) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL11376337 0.76 SMN1; SMN2 (0.67) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL1340139 0.75 SMN1; SMN2 (0.70) LMNATP53ALDH1A1MEN1KMT2A

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-4254259-A HERBICIDES INDIANA UNIVERSITY FOUNDATION (US) 1981-03-03 US disclosed