SCHEMBL11164228

SCHEMBL11164228

COc1ccc2c(c1)c(-c1ccccc1)nc(=O)n2CC(F)(F)Cl

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 8/20 0.57
▸ LMNA P02545 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ GRIK2 Q13002 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL11462576 0.91 CASR (0.59) CASRLMNATP53MAPTGRIK2
SCHEMBL11160051 0.91 CASR (0.59) CASRLMNATP53MAPTGRIK2
SCHEMBL11158937 0.89 CASR (0.57) CASRLMNATP53MAPTGRIK2
SCHEMBL11469861 0.87 CASR (0.55) CASRLMNATP53MAPTGRIK2
SCHEMBL11470963 0.84 MAPT (0.57) LMNATP53MAPTKMT2AKDM4E
SCHEMBL11460792 0.82 CASR (0.62) CASRLMNATP53MAPTGRIK2
SCHEMBL11468901 0.82 CASR (0.51) CASRLMNATP53MAPT
Ciproquazone SCHEMBL287449 0.79 CASR (0.58) CASRLMNATP53MAPTGRIK2
SCHEMBL11467140 0.78 CASR (0.50) CASRLMNATP53MAPT
SCHEMBL11167234 0.78 CASR (0.48) CASRMAPTGRIK2KMT2AKDM4E

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-4387223-A Process for preparing 2(1H)-quinazolinone derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-06-07 — — US disclosed
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