SCHEMBL377227

SCHEMBL377227

Cc1nc(N)nc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 1.00
ALDH1A1 P00352 3/20 1.00
NUDT1 P36639 2/20 1.00
HPGD P15428 2/20 1.00
CYP1A2 P05177 1/20 1.00
GPR3 P46089 1/20 0.65
DCPS Q96C86 1/20 0.63
ADORA2A P29274 4/20 0.58
TP53 P04637 1/20 0.58
MPO P05164 1/20 0.53
RAD52 P43351 1/20 0.53
APP P05067 1/20 0.53
KDM4E B2RXH2 1/20 0.52
GLA P06280 1/20 0.52
CHRM2 P08172 1/20 0.52
ADRA2A P08913 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
CHRM1 P11229 1/20 0.52
NQO2 P16083 1/20 0.52
MAOA P21397 1/20 0.52

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
SCHEMBL30080783 1.00 HSD17B10 (1.00) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL85621 0.79 GPR3 (1.00) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL30025532 0.78 ALDH1A1 (0.64) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL27296318 0.78 ALDH1A1 (0.64) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL440157 0.78 ALDH1A1 (0.64) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL196601 0.77 GPR3 (0.64) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL269636 0.77 DCPS (1.00) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
Hydrochloric Acid SCHEMBL3907848 0.77 GPR3 (0.95) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL29375878 0.77 DCPS (1.00) HSD17B10ALDH1A1NUDT1HPGDCYP1A2
SCHEMBL28042218 0.77 ALDH1A1 (0.62) HSD17B10ALDH1A1NUDT1HPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109776492-A A kind of fluorescence probe and the preparation method and application thereof of the highly selective detection hydrazine of response type 南京林业大学 2019-05-21 CN claimed
EP-1836174-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC. (US) 2007-09-26 EP claimed
WO-2006039718-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2006-04-13 WO claimed
US-12540131-B2 N-(heteroaryl) quinazolin-2-amine derivatives as LRRK2 inhibitors, pharmaceutical compositions, and uses thereof MERCK SHARP & DOHME LLC (US) 2026-02-03 US disclosed
WO-2025068710-A1 COMPOUNDS COMPRISING AN IMIDAZOLE CORE Tay Therapeutics Limited (GB) 2025-04-03 WO disclosed
US-20230023066-A1 N-(HETEROARYL) QUINAZOLIN-2-AMINE DERIVATIVES AS LRRK2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME CORP. (US) 2023-01-26 US disclosed
US-11421223-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2022-08-23 US disclosed
EP-3514152-B1 BENZOCARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2022-06-15 EP disclosed
US-11319328-B2 4β-amino substituted podophyllotoxin derivative and preparation method therefor and use thereof Tang, YaJie 2022-05-03 US disclosed
CN-113651820-A Urea compounds for dual IDO and TDO inhibitors 正大天晴药业集团股份有限公司 2021-11-16 CN disclosed
EP-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 EP disclosed
CN-1617710-A Liposome composition for delivery of nucleic acid ALZA CORP (US) 2005-05-18 CN disclosed
EP-1465599-A1 LIPOSOME COMPOSITION FOR DELIVERY OF NUCLEIC ACID ALZA Corporation (US) 2004-10-13 EP disclosed
US-20040197390-A1 Neutral-cationic lipid for systemic delivery of factor VIII gene HUANG SHI-KUN (US) 2004-10-07 US disclosed
US-20040166150-A1 Neutral-cationic lipid for systemic delivery of Factor VIII gene HUANG SHI-KUN (US) 2004-08-26 US disclosed
WO-2003053409-A1 LIPOSOME COMPOSITION FOR DELIVERY OF NUCLEIC ACID ALZA CORPORATION (US) 2003-07-03 WO disclosed
US-20030031704-A1 Liposome mixture of a lipid that is neutral in charge at physiologic pH and positively charged at pH values less than physiological pH, and a lipid joined to a hydrophilic polymer by an aromatic disulfide linkage, associated with a nucleic ALZA CORPORATION 2003-02-13 US disclosed
WO-2002096390-A1 NEUTRAL-CATIONIC LIPID FOR SYSTEMIC DELIVERY OF FACTOR VIII GENE ALZA CORPORATION (US) 2002-12-05 WO disclosed
WO-1993013079-A1 ANTIFOLATE QUINAZOLINES AGOURON PHARMACEUTICALS, INC. (US) 1993-07-08 WO disclosed
US-4333760-A ARYLSULFONYLURIDOQUINAZOLINES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-06-08 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 (6 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-20040197390-A1 Neutral-cationic lipid for systemic delivery of factor VIII gene F13B, F13A1, F8 HSD17B10 542/4885ALDH1A1 3661/4885NUDT1 4391/4885
US-12540131-B2 N-(heteroaryl) quinazolin-2-amine derivatives as LRRK2 inhibitors, pharmaceutical compositions, and uses thereof LRRK2, PARK7, SNCA HSD17B10 3282/4885ALDH1A1 2665/4885NUDT1 1163/4885
US-11319328-B2 4β-amino substituted podophyllotoxin derivative and preparation method therefor and use thereof WEE1, WEE2, CYP51A1 HSD17B10 2728/4885ALDH1A1 1581/4885NUDT1 3096/4885
US-20030031704-A1 Liposome mixture of a lipid that is neutral in charge at physiologic pH and positively charged at pH values less than physiological pH, and a lipid joined to a hydrophilic polymer by an aromatic disulfide linkage, associated with a nucleic DLST, LIPA, DNAJC10 HSD17B10 2070/4885ALDH1A1 4380/4885NUDT1 1560/4885
US-20230023066-A1 N-(HETEROARYL) QUINAZOLIN-2-AMINE DERIVATIVES AS LRRK2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF LRRK2, CLK2, PARK7 HSD17B10 3838/4885ALDH1A1 4080/4885NUDT1 1086/4885
US-20040166150-A1 Neutral-cationic lipid for systemic delivery of Factor VIII gene F8, F13B, F13A1 HSD17B10 239/4885ALDH1A1 3380/4885NUDT1 4237/4885

“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.