SCHEMBL17385495

SCHEMBL17385495

COc1ccc(NC(=O)c2cc3sc(N4CCCC(N)C4)nc3s2)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.51
TP53 P04637 6/20 0.51
POLB P06746 3/20 0.45
PIM2 Q9P1W9 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
PIN1 Q13526 3/20 0.42
ALDH1A1 P00352 1/20 0.41
NR4A1 P22736 1/20 0.41
KMT2A Q03164 1/20 0.41
MCL1 Q07820 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL17385041 0.90 MAPT (0.52) MAPTTP53POLBSMN1; SMN2RAB9A
SCHEMBL17385379 0.88 TP53 (0.52) MAPTTP53SMN1; SMN2RAB9ANPC1
SCHEMBL17385404 0.88 TP53 (0.50) MAPTTP53POLBSMN1; SMN2RAB9A
SCHEMBL17385433 0.87 TP53 (0.54) MAPTTP53SMN1; SMN2RAB9ANPC1
SCHEMBL17385376 0.86 MAPT (0.47) MAPTTP53POLBPIN1
SCHEMBL17385371 0.86 HRH3 (0.51) MAPTTP53POLBSMN1; SMN2RAB9A
SCHEMBL17385035 0.85 PIN1 (0.50) MAPTTP53POLBSMN1; SMN2RAB9A
SCHEMBL17385402 0.84 PIN1 (0.46) MAPTTP53SMN1; SMN2RAB9ANPC1
SCHEMBL17385355 0.84 SMN1; SMN2 (0.51) MAPTTP53SMN1; SMN2RAB9AALDH1A1
SCHEMBL17385414 0.83 HPGD (0.48) MAPTTP53SMN1; SMN2PIN1ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220153756-A1 ANTI-INFECTIVE COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2022-05-19 US disclosed
EP-3157904-B1 ANTI-INFECTIVE COMPOUNDS PASTEUR INSTITUT KOREA (KR) 2020-11-18 EP disclosed
WO-2015193506-A1 ANTI-INFECTIVE COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2015-12-23 WO 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-20220153756-A1 ANTI-INFECTIVE COMPOUNDS RABGGTB, ELANE, SERPINB1 MAPT 2660/4885TP53 2233/4885POLB 550/4885

“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.