SCHEMBL8788347

SCHEMBL8788347

COCOc1ccc2c(=S)cc(-c3nc4ccccc4[nH]3)oc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.42
SMN1; SMN2 Q16637 8/20 0.42
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 4/20 0.42
PKM P14618 1/20 0.42
MAPT P10636 6/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TP53 P04637 4/20 0.39
ACHE P22303 2/20 0.39
GRM4 Q14833 1/20 0.39
LMNA P02545 2/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38

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
SCHEMBL8787834 0.89 TNKS (0.46) MAOBSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8787875 0.88 MAOB (0.55) MAOBSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8788322 0.80 NPC1 (0.40) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL8787416 0.79 ALDH1A1 (0.49) MAOBSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8787318 0.76 TNKS (0.60) MAOBSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8787178 0.76 SMN1; SMN2 (0.49) MAOBSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8787165 0.75 RAB9A (0.63) MAOBSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8787867 0.74 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL8787268 0.73 MAOB (0.47) MAOBGRM4
SCHEMBL8788339 0.72 NPC1 (0.44) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1

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-0758649-A1 Chromone derivative, process for preparing same and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1997-02-19 EP disclosed