SCHEMBL11668010

SCHEMBL11668010

N#Cc1ccc(NOC(=O)Cc2cccc(N)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 2/20 0.40
ROCK2 O75116 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39
GLS O94925 1/20 0.39
SMPD1 P17405 1/20 0.37
RAB9A P51151 2/20 0.37
MAPK8 P45983 1/20 0.37
SIRT2 Q8IXJ6 3/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
ERCC1 P07992 1/20 0.36
ERCC4 Q92889 1/20 0.36
RORC P51449 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL11666988 0.84 GLS (0.39) MAPTALDH1A1LMNAROCK2GLS
SCHEMBL11664704 0.83 KMT2A (0.45) MEN1MAPTKMT2AALDH1A1ROCK2
SCHEMBL11666834 0.83 GLS (0.41) MEN1MAPTKMT2AALDH1A1GLS
SCHEMBL11665475 0.83 GLS (0.41) MEN1KMT2AALDH1A1ROCK2GLS
SCHEMBL11664782 0.83 GLS (0.41) ALDH1A1ROCK2GLSCYP19A1
SCHEMBL11668184 0.81 SMN1; SMN2 (0.46) MAPTALDH1A1LMNARAB9AKDM4E
SCHEMBL11667823 0.80 FFAR1 (0.45) LMNA
SCHEMBL11667847 0.80 NLRP3 (0.41) GLSRAB9A
SCHEMBL11666869 0.79 HTT (0.41) MEN1MAPTKMT2AALDH1A1LMNA
SCHEMBL11667921 0.78 BRD4 (0.38) ALDH1A1GLSSIRT2KDM4EMAPK1

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-4067726-A 3-Ureido phenylacetamide herbicides BAYER AKTIENGESELLSCHAFT (DT) 1978-01-10 US disclosed