SCHEMBL1737254

SCHEMBL1737254

CCOC(=O)c1cccnc1C(=O)OCC

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ HTT P42858 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ TDP2 O95551 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ PDE4A P27815 1/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ ELANE P08246 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ TP53 P04637 1/20 0.47

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
SCHEMBL29870373 1.00 BRD4 (0.61) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL4914014 0.90 KDM4E (0.61) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL31037820 0.90 KDM4E (0.61) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL7356194 0.90 ALDH1A1 (0.61) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL14840493 0.90 TSHR (0.58) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL14840457 0.87 TSHR (0.54) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL2801546 0.87 BRD4 (0.56) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL12158504 0.87 BRD4 (0.56) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL8407020 0.87 ALDH1A1 (0.64) BRD4TSHRHTTALDH1A1HSD17B10
SCHEMBL21639387 0.86 TSHR (0.53) BRD4TSHRHTTALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3654929-B1 AQUEOUS COSMETIC COMPOSITION COMPRISING A PYRIDINEDICARBOXYLIC ACID DERIVATIVE AND A HYDROXYSTILBENE OREAL (FR) 2024-05-29 — — EP claimed
CN-115322350-A Degradable bio-based polyester and preparation method and application thereof 苏州瀚海新材料有限公司 2022-11-11 — — CN claimed
CN-112142729-B Mefenapyr intermediate and preparation method and application thereof 山东润博生物科技有限公司 2022-09-16 — — CN claimed
WO-2021127642-A1 SELECTIVE VALORIZATION OF BIOMASS SUGARS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-06-24 — — WO claimed
CN-112142729-A Mefenapyr intermediate and preparation method and application thereof 山东润博生物科技有限公司 2020-12-29 — — CN claimed
EP-3654929-A1 AQUEOUS COSMETIC COMPOSITION COMPRISING A PYRIDINEDICARBOXYLIC ACID DERIVATIVE AND A HYDROXYSTILBENE L'OREAL (FR) 2020-05-27 — — EP claimed
EP-3236919-B1 PARTICULAR PYRIDINEDICARBOXYLIC ACID DERIVATIVE/ANTIOXIDANT COMBINATION OREAL (FR) 2019-10-16 — — EP claimed
EP-2861206-B1 COMPOSITION INCLUDING A PYRIDINE DICARBOXYLIC ACID ESTER AND A BINDING POLYMER, METHOD THEREFOR, AND USE THEREOF FOR TREATING HAIR OREAL (FR) 2019-06-12 — — EP claimed
WO-2019016153-A1 AQUEOUS COSMETIC COMPOSITION COMPRISING A PYRIDINEDICARBOXYLIC ACID DERIVATIVE AND A HYDROXYSTILBENE L'OREAL (FR) 2019-01-24 — — WO claimed
EP-3386476-A1 COMPOSITION COMPRISING A POLYMER CONTAINING A SULFONIC MONOMER AND A PYRIDINEDICARBOXYLIC ACID DERIVATIVE, AND COSMETIC TREATMENT METHOD L'Oréal (FR) 2018-10-17 — — EP claimed
US-5124458-A Reacting a dialkyldichlorosuccinate with a dehydrohalogenating agent, treating the reaction product with ammonia, treating the new reaction product with an unsaturated aldehyde or ketone AMERICAN CYANAMID COMPANY (US) 1992-06-23 — — US claimed
US-5118809-A Mixing with ammonium salt and unsaturated aldehydes or ketones AMERICAN CYANAMID COMPANY (US) 1992-06-02 — — US claimed
EP-0461403-A1 Process for the preparation of dialkyl pyridine-2,3-dicarboxylate and derivatives thereof from dialkyl dichlorosucciante AMERICAN CYANAMID COMPANY (US) 1991-12-18 — — EP claimed
EP-0461401-A1 Process for the preparation of dialkyl, pyridine-2,3-dicarboxylates and derivatives thereof from dialkyl dichloromaleate AMERICAN CYANAMID COMPANY (US) 1991-12-18 — — EP claimed
EP-0461402-A1 Process for the preparation of substituted and unsubstituted 2,3-pyridinedicarboxylates from chloromaleate or chlorofumarate or mixtures thereof AMERICAN CYANAMID COMPANY (US) 1991-12-18 — — EP claimed
EP-0456504-A2 Process for preparing pyridinecarboxylic acid derivatives HOECHST CELANESE CORPORATION (US) 1991-11-13 — — EP claimed
EP-0415767-A2 Process for preparing pyridine carboxylic acid derivatives HOECHST CELANESE CORPORATION (US) 1991-03-06 — — EP claimed
EP-0220518-B1 PREPARATION OF SUBSTITUTED AND DISUBSTITUTED PYRIDINE-2,3-DICARBOXYLATE ESTERS AMERICAN CYANAMID COMPANY (US) 1991-02-06 — — EP claimed
US-4723011-A ALPHA-HALO-BETA-KETOESTERS, ALPHA, BETA UNSATURATED KETONE OR ALDEHYDE, AMMONIUM SALT AMERICAN CYANAMID COMPANY (US) 1988-02-02 — — US claimed
EP-0220518-A2 Preparation of substituted and disubstituted pyridine-2,3-dicarboxylate esters AMERICAN CYANAMID COMPANY (US) 1987-05-06 — — EP claimed
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