SCHEMBL7901561

SCHEMBL7901561

Oc1cc(CCl)nc2cc(-c3ccc(Sc4ccccc4)cc3)nn12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
NPC1 O15118 8/20 0.37
RAB9A P51151 8/20 0.37
KDM4E B2RXH2 6/20 0.37
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
HPGD P15428 2/20 0.36
GAA P10253 2/20 0.36
LMNA P02545 2/20 0.36
TP53 P04637 1/20 0.36
NFKB1 P19838 1/20 0.36
HTT P42858 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
CTRC Q99895 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
DHODH Q02127 1/20 0.34

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
SCHEMBL7892524 0.88 MAPT (0.49) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL7901567 0.78 ALDH1A1 (0.37) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL9166079 0.76 MAPT (0.41) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL7436883 0.75 MAPT (0.52) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL959394 0.72 ABCB1 (0.44) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL956425 0.68 KDM4E (0.39) NPC1KDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL7067985 0.67 MAPT (0.74) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL3337830 0.67 CXCR2 (0.52) MAPTNPC1RAB9AKDM4ETP53
SCHEMBL23665936 0.67 FYN (0.46) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL9168007 0.64 MAPT (0.43) MAPTNPC1RAB9AKDM4EALDH1A1

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-6197774-B1 THERAPY FOR ASTHMA, SKIN DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed