SCHEMBL4573547

SCHEMBL4573547

O=C1c2ccccc2C(=O)N1C[C@@H](O)CNc1ccc(Br)c(F)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.69
MAPT P10636 1/20 0.69
RPS6KA2 Q15349 5/20 0.46
KMT2A Q03164 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 2/20 0.41
DNM1 Q05193 1/20 0.39
HSD17B10 Q99714 2/20 0.39
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL4573543 1.00 ALDH1A1 (0.69) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL16701290 0.89 ALDH1A1 (0.66) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL16701293 0.89 ALDH1A1 (0.66) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL16204409 0.80 MAPT (0.55) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL29746037 0.78 ALDH1A1 (0.53) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL16197764 0.78 ALDH1A1 (0.53) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL3941177 0.78 ALDH1A1 (0.53) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL10689999 0.78 ALDH1A1 (0.64) ALDH1A1MAPTKMT2ARAB9AKDM4E
SCHEMBL13232278 0.77 ALDH1A1 (0.75) ALDH1A1MAPTRPS6KA2KMT2ARAB9A
SCHEMBL18263606 0.77 ALDH1A1 (0.63) ALDH1A1MAPTRPS6KA2KMT2ARAB9A

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-2008069619-A1 NOVEL OXAZOLIDINONE DERIVATIVES, PROCESS FOR PREPARING THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LEGOCHEM BIOSCIENCE LTD. (KR) 2008-06-12 WO disclosed