SCHEMBL8624802

SCHEMBL8624802

CCCS(=O)(=O)Nc1cc(N2CCN(CC)CC2)cc(-c2ccccc2Cl)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 2/20 0.39
APAF1 O14727 2/20 0.39
CHRNA7 P36544 1/20 0.39
KMT2A Q03164 2/20 0.38
CNR2 P34972 2/20 0.38
MEN1 O00255 1/20 0.38
CNR1 P21554 1/20 0.38
LMNA P02545 1/20 0.38
BRD4 O60885 2/20 0.38
MITF O75030 2/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
MT-CO2 P00403 1/20 0.37
RIPK2 O43353 1/20 0.37
ACVR1 Q04771 1/20 0.37
NOD2 Q9HC29 1/20 0.37
DRD3 P35462 1/20 0.36
HRH3 Q9Y5N1 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
SCHEMBL8624540 0.94 PGAM1 (0.40) KDM2BAPAF1CHRNA7KMT2ACNR2
SCHEMBL8626684 0.93 CHRNA7 (0.41) KDM2BAPAF1CHRNA7KMT2ACNR2
SCHEMBL8624900 0.91 APAF1 (0.38) APAF1CHRNA7KMT2ABRD4MITF
SCHEMBL8627347 0.91 MITF (0.39) APAF1CHRNA7BRD4MITFRIPK2
SCHEMBL8625881 0.91 BRD4 (0.45) CNR2CNR1BRD4RIPK2ACVR1
Hydrochloric Acid SCHEMBL8625633 0.90 BRD4 (0.38) APAF1CHRNA7BRD4MITFRIPK2
SCHEMBL8630208 0.89 KDM2B (0.41) KDM2BCNR1LMNABRD4RIPK2
SCHEMBL8627903 0.88 APAF1 (0.36) APAF1CHRNA7LMNABRD4MITF
SCHEMBL8628586 0.88 KDM2B (0.40) KDM2BAPAF1CHRNA7BRD4MITF
SCHEMBL8626990 0.87 KDM2B (0.37) KDM2BAPAF1CHRNA7KMT2ACNR2

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-5849912-A Biphenyl derivatives EISAI CO., LTD. (JP) 1998-12-15 US disclosed