SCHEMBL2266601

SCHEMBL2266601

NC(=O)C1Cc2ccccc2N1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.71
MAPT P10636 1/20 0.71
SMYD3 Q9H7B4 1/20 0.44
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
MTNR1A P48039 3/20 0.38
MTNR1B P49286 1/20 0.38
MASP2 O00187 1/20 0.37
F2 P00734 1/20 0.37
AR P10275 1/20 0.37
EPHX2 P34913 1/20 0.36
PTK2B Q14289 1/20 0.36
SCN3A Q9NY46 1/20 0.35
PARP1 P09874 1/20 0.35

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
SCHEMBL30900484 1.00 GAA (0.71) GAAMAPTSMYD3BRD4CREBBP
SCHEMBL10742930 1.00 GAA (0.71) GAAMAPTSMYD3BRD4CREBBP
Hydrochloric Acid SCHEMBL28262901 0.98 GAA (0.69) GAAMAPTSMYD3BRD4CREBBP
Indole SCHEMBL11289138 0.87 MAPT (0.55) GAAMAPTSMYD3MTNR1AMTNR1B
SCHEMBL27556878 0.85 GAA (0.76) GAAMAPTSMYD3BRD4CREBBP
SCHEMBL91080 0.83 GAA (1.00) GAAMAPTSMYD3BRD4CREBBP
SCHEMBL14003020 0.83 GAA (1.00) GAAMAPTSMYD3BRD4CREBBP
SCHEMBL29365197 0.83 GAA (1.00) GAAMAPTSMYD3BRD4CREBBP
SCHEMBL1134239 0.83 GAA (1.00) GAAMAPTSMYD3BRD4CREBBP
SCHEMBL29495388 0.83 GAA (1.00) GAAMAPTSMYD3BRD4CREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4486444-A1 3-ALKYNYL CARBOXAMIDES AS AEP MODULATORS F. Hoffmann-La Roche AG (CH) 2025-01-08 EP claimed
CN-117794896-A Protease inhibitors for the treatment of coronavirus infections 斯克里普斯研究学院 2024-03-29 CN claimed
WO-2023165943-A1 3-ALKYNYL CARBOXAMIDES AS AEP MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2023-09-07 WO claimed
WO-2026098560-A2 BENZENE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2026-05-15 WO disclosed
EP-4486444-A1 3-ALKYNYL CARBOXAMIDES AS AEP MODULATORS F. Hoffmann-La Roche AG (CH) 2025-01-08 EP disclosed
CN-117794896-A Protease inhibitors for the treatment of coronavirus infections 斯克里普斯研究学院 2024-03-29 CN disclosed
WO-2023165943-A1 3-ALKYNYL CARBOXAMIDES AS AEP MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2023-09-07 WO disclosed
WO-2022133588-A1 RNA VIRUS INHIBITOR COMPOUNDS AND USES THEREOF THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2022-06-30 WO disclosed
EP-3704090-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2020-09-09 EP disclosed
CN-109906221-A N- alkyl sulphonyl sulfonylindoline compounds and salt, garderning pesticide and its application method containing the compound 日本农药株式会社 2019-06-18 CN disclosed
WO-2017035352-A1 CARBAMATE, ESTER, AND KETONE COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-02 WO disclosed
WO-1993008188-A1 TRICYCLIC QUINOXALINEDIONES AS GLUTAMATE RECEPTOR ANTAGONISTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1993-04-29 WO disclosed
US-4785118-A Process for preparing indoline-2-carboxylic acids via alpha-hydroxy-2-nitrobenzenepropanoic acid AMERICAN HOME PRODUCTS CORPORATION (US) 1988-11-15 US disclosed
US-4727183-A Process for the asymmetric synthesis of chiral α-hydroxy-2-nitrobenzenepropanoic acid AMERICAN HOME PRODUCTS CORPORATION (US) 1988-02-23 US disclosed
US-4645857-A Process for preparing indoline-2-carboxylic acids via α-hydroxy-2-nitrobenzenepropanoic acid AMERICAN HOME PRODUCTS CORPORATION (US) 1987-02-24 US disclosed
US-4644081-A Process for the asymmetric synthesis of chiral indoline-2-carboxylic acids AMERICAN HOME PRODUCTS CORPORATION (US) 1987-02-17 US disclosed
US-4614806-A Process for the asymmetric synthesis of chiral indoline-2-carboxylic acids AMERICAN HOME PRODUCTS CORPORATION (US) 1986-09-30 US disclosed
US-4585879-A Process for preparing indoline-2-carboxylic acids via alpha-hydroxy-2-nitrobenzenepropanoic acid AMERICAN HOME PRODUCTS CORPORATION (US) 1986-04-29 US disclosed
US-4535168-A Preparation of indoline-2-carboxylic acid via the intermediate indoline-2-carboxylic acid ester tin complex AMERICAN HOME PRODUCTS CORPORATION (US) 1985-08-13 US disclosed
US-4485241-A Reduction of indole-2-carboxylic acids to indoline-2-carboxylic acids with lithium, sodium, or potassium in ammonia AMERICAN HOME PRODUCTS CORPORATION (US) 1984-11-27 US disclosed