SCHEMBL8893711

SCHEMBL8893711

[c]1cc(-c2nc3ccccc3s2)n[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 8/20 0.53
▸ RAB9A P51151 8/20 0.53
▸ KDM4E B2RXH2 7/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ TP53 P04637 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ TSHR P16473 1/20 0.53
▸ ILK Q13418 8/20 0.49
▸ MAPT P10636 4/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ GAA P10253 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ APP P05067 1/20 0.47
▸ MMP9 P14780 1/20 0.47
▸ MMP8 P22894 1/20 0.47

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
SCHEMBL827403 0.77 RAB9A (0.67) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
Hydrogen Sulfide SCHEMBL16859912 0.75 RAB9A (0.64) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL686439 0.74 KDM4E (0.54) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL3073946 0.74 RAB9A (0.69) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL9228500 0.71 APP (0.63) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL366824 0.71 RAB9A (0.81) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL231307 0.71 KDM4E (0.75) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL29474819 0.71 RAB9A (0.81) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL5757471 0.71 RAB9A (0.65) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL24295138 0.70 RAB9A (0.79) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2

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-1997038995-A1 FUNGICIDAL OXAZOLIDINEDIONE DERIVATIVES ZENECA LIMITED (GB) 1997-10-23 — — WO disclosed
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