SCHEMBL1403853

SCHEMBL1403853

CNC(=O)c1cccnn1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.67
AHR P35869 1/20 0.53
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
BRD4 O60885 2/20 0.44
SNCA P37840 1/20 0.43
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
FAAH O00519 1/20 0.41
CES1 P23141 1/20 0.41
HPGD P15428 1/20 0.40
PLK1 P53350 1/20 0.40
ABL1 P00519 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CNR1 P21554 1/20 0.39
BAZ2B Q9UIF8 1/20 0.38
XIAP P98170 1/20 0.37
BIRC2 Q13490 1/20 0.37

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
SCHEMBL22288352 0.87 P2RX7 (0.61) P2RX7AHRKMT2AMEN1BRD4
SCHEMBL29362265 0.87 P2RX7 (0.61) P2RX7AHRKMT2AMEN1BRD4
Hydrochloric Acid SCHEMBL30601969 0.85 P2RX7 (0.59) P2RX7AHRKMT2AMEN1BRD4
Oxalic Acid SCHEMBL30601976 0.83 P2RX7 (0.56) P2RX7AHRKMT2AMEN1BRD4
SCHEMBL1412900 0.82 P2RX7 (0.69) P2RX7AHRKMT2AMEN1SNCA
SCHEMBL30601973 0.81 P2RX7 (0.54) P2RX7AHRKMT2AMEN1SNCA
Sulfuric Acid SCHEMBL30601991 0.81 P2RX7 (0.54) P2RX7AHRKMT2AMEN1SNCA
SCHEMBL109491 0.80 P2RX7 (1.00) P2RX7AHRKMT2AMEN1SNCA
SCHEMBL20905297 0.79 P2RX7 (0.61) P2RX7AHRKMT2AMEN1SNCA
SCHEMBL22290176 0.79 P2RX7 (0.66) P2RX7AHRKMT2AMEN1SNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117794912-A Substituted heterocyclic compounds 百时美施贵宝公司 2024-03-29 CN claimed
US-20240059671-A1 TYROSINE KINASE 2 (TYK2) DEGRADATION COMPOUNDS AND METHODS OF USE CULLGEN (SHANGHAI) , INC. (CN) 2024-02-22 US claimed
CN-117377669-A TYK2 inhibitor and application thereof 苏多生物科学有限公司 2024-01-09 CN claimed
CN-117321043-A Substituted heterocyclic compounds 百时美施贵宝公司 2023-12-29 CN claimed
CN-117242072-A TYK2 inhibitor and application thereof 苏多生物科学有限公司 2023-12-15 CN claimed
WO-2023213308-A1 AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF 苏州隆博泰药业有限公司 2023-11-09 WO claimed
CN-111936486-B Heterocyclic compounds comprising pyridine as modulators of IL-12, IL-23 and/or IFN alpha responses 百时美施贵宝公司 2023-09-22 CN claimed
CN-111936486-A Pyridine-containing heterocyclic compounds useful as modulators of IL-12, IL-23, and/or IFN alpha response 百时美施贵宝公司 2020-11-13 CN claimed
CN-102015716-A Imidazo [1,2-b] pyridazine derivatives for the treatment of C-MET tyrosine kinase mediated disease NOVARTIS AG 2011-04-13 CN claimed
US-20260055121-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LTD (GB) 2026-02-26 US disclosed
US-20250179022-A1 COMPOUND USED AS TYK2 INHIBITOR, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF SHANGHAI ZHIGEN PHARMACEUTICAL & TECHNOLOGY CO. LTD. (CN) 2025-06-05 US disclosed
CN-120040441-A Compositions and methods for treating cancer A2A制药有限公司 2025-05-27 CN disclosed
CN-119522217-A Compositions and methods for treating cancer A2A制药有限公司 2025-02-25 CN disclosed
CN-119317622-A Compounds useful as TYK2 inhibitors, preparation method and application thereof in medicine 上海致根医药科技有限公司 2025-01-14 CN disclosed
CN-111936486-A Pyridine-containing heterocyclic compounds useful as modulators of IL-12, IL-23, and/or IFN alpha response 百时美施贵宝公司 2020-11-13 CN disclosed
CN-104884454-B The heterocyclic compound of acid amides substitution as IL 12, IL 23 and/or IFN α answer-reply regulator 百时美施贵宝公司 2017-11-28 CN disclosed
CN-104781252-B Alkyl-amide substituted pyridine compounds useful as IL-12, IL-23 and/or IFN alpha response modulators 百时美施贵宝公司 2017-11-17 CN disclosed
CN-102015716-A Imidazo [1,2-b] pyridazine derivatives for the treatment of C-MET tyrosine kinase mediated disease NOVARTIS AG 2011-04-13 CN disclosed
EP-2291371-A1 CYCLIC INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE 1 Vitae Pharmaceuticals, Inc. (US) 2011-03-09 EP disclosed
US-20070208005-A1 TETRAHYDROBENZAZEPINES AS ANTAGONISTS AND/OR REVERSE AGONISTS OF THE HISTAMINE H3 RECEPTOR GLAXO GROUP LIMITED (GB) 2007-09-06 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 (4 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-20250179022-A1 COMPOUND USED AS TYK2 INHIBITOR, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF TYK2, WEE2, WEE1 P2RX7 3417/4885AHR 1044/4885KMT2A 276/4885
US-20240059671-A1 TYROSINE KINASE 2 (TYK2) DEGRADATION COMPOUNDS AND METHODS OF USE TYK2, ERBB2, PTK2B P2RX7 3943/4885AHR 1216/4885KMT2A 560/4885
US-20260055121-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, CSNK2A3, CSNK2B P2RX7 4340/4885AHR 797/4885KMT2A 390/4885
US-20070208005-A1 TETRAHYDROBENZAZEPINES AS ANTAGONISTS AND/OR REVERSE AGONISTS OF THE HISTAMINE H3 RECEPTOR HRH3, HRH4, HRH1 P2RX7 356/4885AHR 200/4885KMT2A 209/4885

“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.