SCHEMBL19917844

SCHEMBL19917844

c1ccc(-c2ccc3nc4n(c3c2)Cc2cccc3cccc-4c23)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.51
RAB9A P51151 7/20 0.51
KDM4E B2RXH2 5/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
HSD17B10 Q99714 2/20 0.51
TSHR P16473 2/20 0.51
TP53 P04637 1/20 0.51
PKM P14618 1/20 0.51
ALDH1A1 P00352 2/20 0.42
MAPT P10636 4/20 0.41
MAPK1 P28482 2/20 0.41
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.36
GAA P10253 1/20 0.36
CYP2C9 P11712 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
SCHEMBL9413470 0.83 KDM4E (0.74) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL22955294 0.82 RAB9A (0.50) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL29553308 0.79 KDM4E (0.42) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL20798560 0.74 HSP90AA1 (0.35) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL22955859 0.74 KDM4E (0.50) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL29808364 0.74 KDM4E (0.50) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL19917859 0.72 KDM4E (0.58) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL23024617 0.71 KDM4E (0.38) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL22334748 0.71 PIK3CA (0.34) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL23132206 0.69 PARP1 (0.49) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10

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
EP-2718395-B1 Novel illumination device comprising a colour converter BASF SE (DE) 2018-02-28 EP disclosed