SCHEMBL452908

SCHEMBL452908

c1ccc2nc3c(cc2c1)CCCC3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
ACHE P22303 6/20 0.48
ALDH1A1 P00352 4/20 0.48
MAPT P10636 3/20 0.48
GLA P06280 1/20 0.48
HPGD P15428 1/20 0.48
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
CTSK P43235 1/20 0.47
TSHR P16473 4/20 0.44
HSD17B10 Q99714 3/20 0.44
CYP2D6 P10635 3/20 0.44
MAPK1 P28482 3/20 0.44
KDM4E B2RXH2 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
TP53 P04637 2/20 0.44

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
SCHEMBL30645420 1.00 NPC1 (0.49) NPC1RAB9AKMT2AMEN1ACHE
SCHEMBL9347454 0.98 KMT2A (0.48) NPC1RAB9AKMT2AMEN1ACHE
Hydrochloric Acid SCHEMBL4353079 0.98 NPC1 (0.48) NPC1RAB9AKMT2AMEN1ACHE
Ammonia Solution, Strong SCHEMBL9633554 0.98 NPC1 (0.48) NPC1RAB9AKMT2AMEN1ACHE
Hydrochloric Acid SCHEMBL28201693 0.96 KMT2A (0.47) NPC1RAB9AKMT2AMEN1ACHE
Hydrochloric Acid SCHEMBL30688272 0.96 CTSL (0.49) NPC1RAB9AKMT2AMEN1ACHE
Hydrochloric Acid SCHEMBL28869036 0.96 CTSL (0.49) NPC1RAB9AKMT2AMEN1ACHE
SCHEMBL3506845 0.96 NPC1 (0.49) NPC1RAB9AKMT2AMEN1ACHE
Bicarbonate SCHEMBL4200785 0.91 ALDH1A1 (0.49) NPC1RAB9AKMT2AMEN1ACHE
SCHEMBL31742513 0.88 ALDH1A1 (0.45) NPC1RAB9AKMT2AMEN1ACHE

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 1477 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026041736-A1 FORMATION OF METHANE FROM SIDE PRODUCTS OF AN ALCOHOL CONVERSION PROCESS BASF SE (DE) 2026-02-26 WO claimed
WO-2026041750-A1 AN ALCOHOL CONVERSION PROCESS BASF SE (DE) 2026-02-26 WO claimed
WO-2026041735-A1 AN ALCOHOL CONVERSION PROCESS BASF SE (DE) 2026-02-26 WO claimed
WO-2025040770-A1 AN ALCOHOL CONVERSION PROCESS BASF SE (DE) 2025-02-27 WO claimed
CN-119390586-A Process for preparing aromatic polyamine mixtures 巴斯夫欧洲公司 2025-02-07 CN claimed
CN-110143956-B Tacrine-pyridothiophene compound and preparation method and application thereof 中国药科大学 2022-07-29 CN claimed
CN-113861128-A Polymerizable compound and optically anisotropic body 江苏创拓新材料有限公司 2021-12-31 CN claimed
CN-111704576-A Synthesis method and application of axial chiral 9-aryl tetrahydroacridine 菏泽学院 2020-09-25 CN claimed
US-20200271587-A1 VISIBLE LIGHT-ACTIVATED DYES AND METHODS OF USE THEREOF WILLIAM MARSH RICE UNIVERSITY 2020-08-27 US claimed
US-20200165608-A1 INHIBITION OF VASCULAR ENDOTHELIAL CELL-MEDIATED PHAGOCYTIC PROCESSES FOR TREATMENT OF DEMYELINATING CONDITIONS NATIONAL SCIENCE FOUNDATION 2020-05-28 US claimed
EP-0732926-B1 PHARMACEUTICAL FORMULATION FOR PREVENTING OR PRE-TREATING POISONING BY ORGANOPHOSPHORIC CHOLINESTERASE INHIBITORS LOHMANN THERAPIE SYST LTS (DE) 2003-02-19 EP claimed
CN-1328451-A Medicine for improving excretion capacity of bladder TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-26 CN claimed
US-6114347-A Pharmaceutical formulation for the prophylaxis and pretreatment of a poisoning caused by organophosphorus cholinesterase inhibitors LTS LOHMANN THERAPIE-SYSTEME GMBH (DE) 2000-09-05 US claimed
US-5939095-A AT LEAST ONE PARASYMPATHOMIMETICALLY ACTIVE SUBSTANCE AND AT LEAST ONE PARASYMPATHOLYTICALLY ACTIVE SUBSTANCE LTS LOHMANN THERAPIE-SYSTEME GMBH (DE) 1999-08-17 US claimed
CN-1222512-A Improved amino acridine preparing process UNIV BEIJING SCIENCE & TECH (CN) 1999-07-14 CN claimed
EP-0732926-A1 PHARMACEUTICAL FORMULATION FOR PREVENTING OR PRE-TREATING POISONING BY ORGANOPHOSPHORIC CHOLINESTERASE INHIBITORS LTS LOHMANN Therapie-Systeme GmbH (DE) 1996-09-25 EP claimed
EP-0732924-A1 TRANSDERMAL THERAPEUTICAL SYSTEM FOR PREVENTING POISONING BY ORGANOPHOSPHORIC NUROTOXINS THAT CONSISTS OF A COMBINATION OF ACTIVE SUBSTANCES INCLUDING A PARASYMPATHOMIMETIC AND A PARASYMPATHOLYTIC AGENT LTS LOHMANN Therapie-Systeme GmbH (DE) 1996-09-25 EP claimed
EP-0375471-B1 Use of 1,2,3,4-tetrahydro-acridines in the treatment of AIDS, and compounds RECH NEWPHARM SOC CIV DE (FR) 1996-04-10 EP claimed
WO-1995015755-A1 TRANSDERMAL THERAPEUTICAL SYSTEM FOR PREVENTING POISONING BY ORGANOPHOSPHORIC NUROTOXINS THAT CONSISTS OF A COMBINATION OF ACTIVE SUBSTANCES INCLUDING A PARASYMPATHOMIMETIC AND A PARASYMPATHOLYTIC AGENT LTS LOHMANN THERAPIE-SYSTEME GMBH (DE) 1995-06-15 WO claimed
WO-1995015756-A1 PHARMACEUTICAL FORMULATION FOR PREVENTING OR PRE-TREATING POISONING BY ORGANOPHOSPHORIC CHOLINESTERASE INHIBITORS LTS LOHMANN THERAPIE-SYSTEME GMBH (DE) 1995-06-15 WO claimed

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-20200271587-A1 VISIBLE LIGHT-ACTIVATED DYES AND METHODS OF USE THEREOF HCCS, CLTB, ALDH1A2 NPC1 2031/4885RAB9A 509/4885KMT2A 3471/4885

“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.