SCHEMBL21778995

SCHEMBL21778995

SSCSc1ccc2ncsc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 8/20 0.41
▸ RAB9A P51151 8/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HKDC1 Q2TB90 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ DYRK1A Q13627 4/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TAS1R3 Q7RTX0 1/20 0.35
▸ TAS1R1 Q7RTX1 1/20 0.35
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ GFER P55789 1/20 0.34
▸ PKM P14618 1/20 0.33
▸ APP P05067 1/20 0.33
▸ RIPK1 Q13546 1/20 0.33
▸ DYRK2 Q92630 3/20 0.33
▸ DYRK1B Q9Y463 3/20 0.33

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
SCHEMBL9016292 0.77 TAS1R3 (0.43) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL4054163 0.74 NPC1 (0.47) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL10384497 0.74 NPC1 (0.51) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL10384501 0.70 RAB9A (0.44) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL11706963 0.70 ALDH1A1 (0.43) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL10385317 0.68 NPC1 (0.45) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL2679831 0.67 NPC1 (0.52) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL24214588 0.67 DAO (0.53) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL10230254 0.67 NPC1 (0.47) NPC1RAB9AKDM4EHKDC1TDP1
SCHEMBL22864979 0.67 MEN1 (0.41) NPC1RAB9AKDM4ETDP1L3MBTL1

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
US-10577344-B2 Therapeutics targeting truncated adenomatous polyposis coli (APC) proteins THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-03-03 — — US 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-10577344-B2 Therapeutics targeting truncated adenomatous polyposis coli (APC) proteins APC, VHL, TP53 NPC1 1051/4885RAB9A 3153/4885KDM4E 2086/4885

“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.

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