SCHEMBL7208787

SCHEMBL7208787

c1ccc2sc(-c3ccc(-c4nc5ccccc5s4)nc3)nc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.71
NPC1 O15118 7/20 0.71
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
KDM4E B2RXH2 5/20 0.62
ALDH1A1 P00352 3/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
TP53 P04637 2/20 0.62
HSD17B10 Q99714 2/20 0.62
TSHR P16473 1/20 0.62
APP P05067 5/20 0.60
MAPT P10636 3/20 0.60
GLA P06280 2/20 0.60
GAA P10253 2/20 0.60
MMP9 P14780 2/20 0.60
MMP8 P22894 2/20 0.60
LMNA P02545 2/20 0.60
PKM P14618 1/20 0.55
ILK Q13418 1/20 0.55
PAX8 Q06710 1/20 0.55

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
SCHEMBL787048 0.95 RAB9A (0.64) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL6745928 0.84 RAB9A (0.52) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL10045325 0.83 RAB9A (0.68) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL14268621 0.83 RAB9A (0.68) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL21471952 0.83 RAB9A (0.68) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL4639944 0.83 RAB9A (1.00) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL29474819 0.83 RAB9A (0.81) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL366824 0.83 RAB9A (0.81) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL24156046 0.81 RAB9A (0.60) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL11426677 0.81 RAB9A (0.60) RAB9ANPC1MEN1KMT2AKDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605904-B2 Tunable multicolor electroluminescent device UNIVERSITY OF ROCHESTER 2003-08-12 US disclosed
US-20020097001-A1 Tunable multicolor electroluminescent device NATIONAL SCIENCE FOUNDATION 2002-07-25 US disclosed