SCHEMBL19736085

SCHEMBL19736085

O=C(O)CN1C(=O)/C(=C/c2cccc(OCc3ccc(Cl)cc3)c2)SC1=S

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 1.00
KMT2A Q03164 7/20 1.00
POLB P06746 4/20 1.00
AKR1B1 P15121 9/20 0.85
PTPN1 P18031 6/20 0.85
MMP3 P08254 3/20 0.85
MMP13 P45452 3/20 0.85
GFER P55789 1/20 0.85
NPC1 O15118 1/20 0.79
RAB9A P51151 1/20 0.79
PTPN2 P17706 1/20 0.68

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
SCHEMBL29408626 1.00 MEN1 (1.00) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL6887210 0.92 AKR1B1 (1.00) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL6887214 0.92 AKR1B1 (1.00) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL19736049 0.92 AKR1B1 (1.00) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL29364415 0.91 KMT2A (0.86) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL12008503 0.91 KMT2A (0.86) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL25992272 0.91 AKR1B1 (0.85) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL12008515 0.89 KMT2A (0.80) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL19736097 0.88 AKR1B1 (0.83) MEN1KMT2APOLBAKR1B1PTPN1
SCHEMBL29408634 0.88 AKR1B1 (0.83) MEN1KMT2APOLBAKR1B1PTPN1

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-20190307729-A1 ANTIMICROBIAL COMPOUNDS AND METHODS FOR USE THEREOF VERSITECH LIMITED (HK) 2019-10-10 US disclosed
WO-2017215552-A1 ANTIMICROBIAL COMPOUNDS AND METHODS FOR USE THEREOF THE UNIVERSITY OF HONG KONG (CN) 2017-12-21 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-20190307729-A1 ANTIMICROBIAL COMPOUNDS AND METHODS FOR USE THEREOF NRDC, NISCH, NEK5 MEN1 1047/4885KMT2A 4486/4885POLB 1616/4885

“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.