SCHEMBL15660874

SCHEMBL15660874

c1csc(-c2cccc3cncnc23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.43
ALDH1A1 P00352 9/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
KDM4E B2RXH2 4/20 0.42
HPGD P15428 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HSD17B10 Q99714 7/20 0.40
CYP3A4 P08684 6/20 0.40
CYP2C9 P11712 6/20 0.40
CASP1 P29466 6/20 0.40
CASP7 P55210 6/20 0.40
CYP1A2 P05177 5/20 0.40
CLK4 Q9HAZ1 4/20 0.40
USP2 O75604 3/20 0.40
HIF1A Q16665 1/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39

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
SCHEMBL3074807 0.80 EGFR (0.50) ALDH1A1KDM4ETDP1MAPTHSD17B10
SCHEMBL6666438 0.78 KDM4E (0.52) ADRB1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL28132260 0.77 KDM4E (0.50) ADRB1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL28335119 0.77 KDM4E (0.50) ADRB1ALDH1A1MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL6667707 0.77 KDM4E (0.50) ADRB1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL31038714 0.74 EGFR (0.44) KDM4ECYP3A4CYP1A2ATMCYP2A6
SCHEMBL29248284 0.73 TNF (0.47) KDM4ECYP3A4CYP1A2ATMMAPK10
SCHEMBL6968376 0.72 KDM4E (0.47) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL28115994 0.71 CYP3A4 (0.42) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL29576347 0.70 CYP1A2 (0.44) ALDH1A1MEN1KMT2AKDM4ETDP1

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-2014066506-A2 COMPOSITIONS AND METHODS FOR JAMM PROTEIN INHIBITION CLEAVE BIOSCIENCES, INC. (US) 2014-05-01 WO disclosed