SCHEMBL4725807

SCHEMBL4725807

CCn1c2ccccc2c2cc(NC(=O)c3ccc(Cl)cc3)ccc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.72
MEN1 O00255 11/20 0.72
KMT2A Q03164 11/20 0.72
KDM4E B2RXH2 8/20 0.69
POLB P06746 4/20 0.69
RECQL P46063 1/20 0.69
LMNA P02545 7/20 0.69
ALDH1A1 P00352 5/20 0.69
SMN1; SMN2 Q16637 4/20 0.69
HPGD P15428 4/20 0.69
HCRTR1 O43613 2/20 0.69
RAB9A P51151 2/20 0.69
PAX8 Q06710 1/20 0.69
NPSR1 Q6W5P4 2/20 0.67
NPC1 O15118 1/20 0.66
HTT P42858 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.64
USP2 O75604 1/20 0.62
ALPI P09923 1/20 0.62
MAPK1 P28482 1/20 0.62

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
SCHEMBL7722872 0.90 MAPT (0.75) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL6226561 0.89 MAPT (0.74) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL30138765 0.88 MAPT (0.70) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL4727129 0.88 MAPT (0.73) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL28906026 0.88 MAPT (0.70) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL4728014 0.88 MAPT (0.72) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL4728662 0.86 MAPT (0.70) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL6231487 0.86 MAPT (0.83) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL4725265 0.86 NPY5R (0.72) MAPTMEN1KMT2AKDM4EPOLB
SCHEMBL19757536 0.85 MAPT (0.68) MAPTMEN1KMT2AKDM4EPOLB

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-2008021745-A2 HEPATITIS C VIRUS ENTRY INHIBITORS ITHERX PHARMACEUTICALS, INC. (US) 2008-02-21 WO disclosed