SCHEMBL6471640

SCHEMBL6471640

NCc1ccccc1Cc1c[nH]c(=O)c(Br)c1OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPYD Q12882 1/20 0.41
POLB P06746 1/20 0.39
PNP P00491 1/20 0.39
TRPM8 Q7Z2W7 2/20 0.38
LTA4H P09960 2/20 0.38
PLA2G2A P14555 2/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MAOB P27338 1/20 0.35
NSD2 O96028 1/20 0.35
ABL1 P00519 1/20 0.35
PPARG P37231 1/20 0.35
RIN1 Q13671 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
LMNA P02545 2/20 0.35
MITF O75030 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL6473794 0.83 SIRT2 (0.40) DPYDPOLBPNPLTA4HPLA2G2A
SCHEMBL6472862 0.82 IMPDH2 (0.40) DPYDPOLBPNPMAPTKDM4E
SCHEMBL6472151 0.80 PARP10 (0.49) DPYDPNPPLA2G2AKDM4EMAOB
SCHEMBL6652475 0.80 DPYD (0.41) DPYDPOLBPNPPPARGTHRA
SCHEMBL6472836 0.80 NR4A1 (0.47) DPYDPNPKMT2ATSHRSMN1; SMN2
SCHEMBL6471088 0.80 THRA (0.45) DPYDPOLBNSD2ABL1PPARG
SCHEMBL4379215 0.79 MAPT (0.41) DPYDMAPTMAOBL3MBTL1LMNA
SCHEMBL6472152 0.79 MAOB (0.47) DPYDPOLBPNPMAOBGAA
SCHEMBL6471484 0.78 DPYD (0.46) DPYDMAPTKDM4ETHRATHRB
SCHEMBL6647198 0.78 PNP (0.40) DPYDPOLBPNPPLA2G2AMAPT

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-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed