SCHEMBL2230941

SCHEMBL2230941

NC(=O)c1cnc2ccsc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HKDC1 Q2TB90 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NNMT P40261 5/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHEK2 O96017 2/20 0.39
PSMD14 O00487 1/20 0.39
STAMBP O95630 1/20 0.39
COPS5 Q92905 1/20 0.39
PARP15 Q460N3 1/20 0.37
PARP10 Q53GL7 1/20 0.37
NTRK1 P04629 1/20 0.37
GRM5 P41594 1/20 0.36
DYRK1A Q13627 1/20 0.36
CHEK1 O14757 1/20 0.36
APP P05067 1/20 0.36

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
SCHEMBL30711905 1.00 HPGDS (0.44) HPGDSNPC1RAB9AKDM4EL3MBTL1
SCHEMBL843647 0.84 NPC1 (0.57) NPC1RAB9AKDM4EL3MBTL1HKDC1
SCHEMBL30895185 0.84 NPC1 (0.57) NPC1RAB9AKDM4EL3MBTL1HKDC1
SCHEMBL10660456 0.83 NPC1 (0.44) HPGDSNPC1RAB9AKDM4EL3MBTL1
SCHEMBL12663281 0.82 NPC1 (0.41) HPGDSNPC1RAB9AKDM4EL3MBTL1
SCHEMBL21621626 0.79 MAPK1 (0.46) HPGDSNPC1RAB9AKDM4EL3MBTL1
SCHEMBL22079499 0.77 NNMT (0.45) NNMT
SCHEMBL25272200 0.75 HPGDS (0.52) HPGDSNPC1RAB9AKDM4EL3MBTL1
SCHEMBL3941119 0.75 NPC1 (0.41) HPGDSNPC1RAB9AKDM4EL3MBTL1
SCHEMBL1219793 0.74 KDM4E (0.42) HPGDSNPC1RAB9AKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11673886-B2 5-membered and bicyclic heterocyclic amides as inhibitors of ROCK BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-13 US claimed
US-20220356179-A1 5-MEMBERED AND BICYCLIC HETEROCYCLIC AMIDES AS INHIBITORS OF ROCK BRISTOL MYERS SQUIBB CO (US) 2022-11-10 US claimed
US-20250049036-A1 SUBSTITUTED FUSED BICYCLIC PYRIDINE CARBOXAMIDE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2025-02-13 US disclosed
US-20240166651-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-05-23 US disclosed
US-20210139507-A1 FUSED PYRIDINES WHICH ACT AS INHIBITORS OF H PGDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-05-13 US disclosed
US-20210139507-A1 FUSED PYRIDINES WHICH ACT AS INHIBITORS OF H PGDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-05-13 US disclosed
EP-3724197-A1 FUSED PYRIDINES WHICH ACT AS INHIBITORS OF H-PGDS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2020-10-21 EP disclosed
WO-2019116256-A1 FUSED PYRIDINES WHICH ACT AS INHIBITORS OF H-PGDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-06-20 WO disclosed
US-20110263642-A1 METHODS FOR TREATMENT OF MULTIPLE SCLEROSIS FIBROGEN, INC. (US) 2011-10-27 US disclosed
CN-1980937-B Thienopyridone carboxamides and their medical use ACTIVE BIOTECH AB 2011-08-10 CN disclosed
EP-2341904-A1 METHODS FOR TREATMENT OF MULTIPLE SCLEROSIS Fibrogen, Inc. (US) 2011-07-13 EP disclosed
WO-2010024908-A1 METHODS FOR TREATMENT OF MULTIPLE SCLEROSIS FIBROGEN, INC. (US) 2010-03-04 WO disclosed
WO-2010024911-A1 METHODS FOR INCREASING NEUROGENESIS FIBROGEN, INC. (US) 2010-03-04 WO disclosed
US-7553849-B2 Compounds ACTIVE BIOTECH AB (SE) 2009-06-30 US disclosed
EP-1776369-B1 THIENOPYRIDONE CARBOXAMIDES AND THEIR MEDICAL USE ACTIVE BIOTECH AB (SE) 2007-10-10 EP disclosed
CN-1980937-A Thienopyridone carboxamides and their medical use ACTIVE BIOTECH AB (SE) 2007-06-13 CN disclosed
EP-1776369-A1 THIENOPYRIDONE CARBOXAMIDES AND THEIR MEDICAL USE Active Biotech AB (SE) 2007-04-25 EP disclosed
US-20060004038-A1 Novel compounds ACTIVE BIOTECH AB (SE) 2006-01-05 US disclosed
WO-2005123744-A1 THIENOPYRIDONE CARBOXAMIDES AND THEIR MEDICAL USE ACTIVE BIOTECH AB (SE) 2005-12-29 WO disclosed
US-4877793-A CARDIOVASCULAR DISORDERS THE BOOTS COMPANY, PLC (GB) 1989-10-31 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 (7 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-11673886-B2 5-membered and bicyclic heterocyclic amides as inhibitors of ROCK MYLK, ROCK1, ROCK2 HPGDS 599/4885NPC1 4398/4885RAB9A 456/4885
US-20240166651-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS TYK2, JAK3, JAK1 HPGDS 526/4885NPC1 4516/4885RAB9A 3268/4885
US-20060004038-A1 Novel compounds REL, CLIC4, C5 HPGDS 2188/4885NPC1 1675/4885RAB9A 1791/4885
US-20250049036-A1 SUBSTITUTED FUSED BICYCLIC PYRIDINE CARBOXAMIDE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CBR3, C5, CBR1 HPGDS 4772/4885NPC1 3323/4885RAB9A 585/4885
US-20220356179-A1 5-MEMBERED AND BICYCLIC HETEROCYCLIC AMIDES AS INHIBITORS OF ROCK MYLK, ROCK1, ROCK2 HPGDS 599/4885NPC1 4398/4885RAB9A 456/4885
US-20110263642-A1 METHODS FOR TREATMENT OF MULTIPLE SCLEROSIS PMP22, MAG, NEFM HPGDS 1373/4885NPC1 1125/4885RAB9A 3751/4885
US-20210139507-A1 FUSED PYRIDINES WHICH ACT AS INHIBITORS OF H PGDS HPGDS, HPGD, PTGS1 HPGDS 1/4885NPC1 3749/4885RAB9A 3439/4885

“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.