SCHEMBL6310313

SCHEMBL6310313

NC(=O)c1csc(NC(=O)c2ccccc2)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.64
RAB9A P51151 4/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
KDM4A O75164 2/20 0.58
KDM4B O94953 2/20 0.58
KDM5B Q9UGL1 2/20 0.58
ADORA3 P0DMS8 1/20 0.58
SCD O00767 1/20 0.57
MAPT P10636 4/20 0.56
KDM4E B2RXH2 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
PDE5A O76074 1/20 0.56
ALDH1A1 P00352 1/20 0.56
PKM P14618 1/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
HSD17B10 Q99714 1/20 0.56
LMNA P02545 2/20 0.54
HTT P42858 2/20 0.54

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
SCHEMBL3603304 0.88 NPC1 (0.68) NPC1RAB9ASMN1; SMN2KDM4AKDM4B
SCHEMBL419446 0.87 MAPT (0.65) NPC1RAB9ASMN1; SMN2KDM4AKDM4B
SCHEMBL3180253 0.81 NPC1 (0.68) NPC1RAB9ASMN1; SMN2KDM4AKDM4B
SCHEMBL8881445 0.81 NPC1 (0.63) NPC1RAB9ASMN1; SMN2KDM4AKDM4B
SCHEMBL21066336 0.80 L3MBTL1 (0.54) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL419064 0.80 ALDH1A1 (0.58) NPC1RAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL27827106 0.80 AMY1A (0.63) RAB9ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL28251184 0.79 NPC1 (0.57) NPC1RAB9ASMN1; SMN2KDM4AKDM4B
SCHEMBL5717620 0.78 KDM4E (0.74) NPC1RAB9ASMN1; SMN2KDM4AKDM4B
SCHEMBL3260627 0.78 NPC1 (0.68) NPC1RAB9ASMN1; SMN2KDM4AKDM4B

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-20050143581-A1 Process for preparation of alkoxybenzamides and thiazolyl isocyanates MITSUI CHEMICALS, INC. (JP) 2005-06-30 US disclosed
EP-1489073-A1 PROCESS FORPREPARATION OF ALKOXYBENZAMIDES AND THIAZOLYL ISOCYANATES MITSUI CHEMICALS, INC. (JP) 2004-12-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050143581-A1 Process for preparation of alkoxybenzamides and thiazolyl isocyanates CBR3, CBR1, IDH1 NPC1 3375/4885RAB9A 2103/4885SMN1; SMN2 4217/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.