SCHEMBL8524654

SCHEMBL8524654

COC(=O)c1c(Sc2ccc(OC)cc2)nc(Sc2ccc(OC)cc2)n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.39
ALDH1A1 P00352 4/20 0.39
BRS3 P32247 3/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
EDNRA P25101 1/20 0.38
KMT2A Q03164 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 2/20 0.36
ATM Q13315 1/20 0.36
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 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
SCHEMBL6579920 0.92 EDNRA (0.46) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD
SCHEMBL8431636 0.92 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD
SCHEMBL8433247 0.91 BRS3 (0.39) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD
SCHEMBL6580198 0.90 EDNRA (0.44) SMN1; SMN2ALDH1A1KDM4EHPGDEDNRA
SCHEMBL8323946 0.88 EDNRB (0.40) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD
SCHEMBL8329557 0.87 MEN1 (0.39) SMN1; SMN2ALDH1A1KDM4EHPGDEDNRA
SCHEMBL8329904 0.87 PPARG (0.38) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD
SCHEMBL6579951 0.86 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD
SCHEMBL8431530 0.84 EDNRA (0.37) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD
SCHEMBL8434942 0.84 BRS3 (0.42) SMN1; SMN2ALDH1A1BRS3KDM4EHPGD

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-5856509-A HYPOTENSIVE AGENTS ROUSSEL UCLAF (FR) 1999-01-05 US disclosed