SCHEMBL5795696

SCHEMBL5795696

CCOC(=O)n1nccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
LMNA P02545 3/20 0.40
HSD17B10 Q99714 1/20 0.40
ALOX15 P16050 1/20 0.39
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
SOAT1 P35610 1/20 0.39
LPO P22079 4/20 0.37
CYP1A2 P05177 2/20 0.37
TSHR P16473 2/20 0.36
PDE4A P27815 1/20 0.36
TRPA1 O75762 1/20 0.36
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 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
SCHEMBL21043036 0.76 NPSR1 (0.37) ALDH1A1LMNAMGAMGAASI
SCHEMBL3735768 0.73 FAAH (0.37) ALDH1A1LMNAHSD17B10ALOX15FAAH
SCHEMBL315410 0.71 HSD17B10 (0.49) ALDH1A1HSD17B10MGAMGAASI
SCHEMBL5792153 0.71 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10ALOX15FAAH
SCHEMBL16589233 0.70 CYP2C9 (0.45) ALDH1A1LMNAGAACYP1A2POLB
SCHEMBL4053266 0.70 NPSR1 (0.42) ALDH1A1LMNAHSD17B10ALOX15GAA
SCHEMBL948446 0.70 ELANE (0.46) ALDH1A1HSD17B10TSHRPDE4A
SCHEMBL217356 0.70 ALDH1A1 (0.42) ALDH1A1LMNAFAAHMGLLLPO
SCHEMBL19716165 0.70 CYP4F2 (0.40) ALDH1A1LMNAHSD17B10ALOX15MGAM
Hydrochloric Acid SCHEMBL3817658 0.69 ELANE (0.45) ALDH1A1HSD17B10TSHRPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023202364-A1 HERBICIDAL COMPOSITION COMPRISING PYRIMIDINE FORMYL OXIME DERIVATIVE AND USE THEREOF 青岛清原作物科学有限公司 2023-10-26 WO disclosed
WO-2023197899-A1 HERBICIDAL COMPOSITION CONTAINING FUSED RING-SUBSTITUTED AROMATIC COMPOUND AND USE THEREOF 青岛清原作物科学有限公司 2023-10-19 WO disclosed
CN-111269221-B Bicyclic lactams and methods of use thereof 豪夫迈·罗氏有限公司 2023-09-26 CN disclosed
EP-4172153-A1 SUBSTITUTED HETEROARYLOXYPYRIDINES, THE SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS Bayer Aktiengesellschaft (DE) 2023-05-03 EP disclosed
CN-110023313-B Bicyclic amide compounds and methods of use thereof 豪夫迈·罗氏有限公司 2022-10-25 CN disclosed
CN-110072863-B RIP1 kinase inhibitors and methods of use 豪夫迈·罗氏有限公司 2022-08-30 CN disclosed
EP-4003975-A1 SUBSTITUTED N-PHENYL-N-AMINOUARCILS AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL AGENTS Bayer Aktiengesellschaft (DE) 2022-06-01 EP disclosed
EP-3947350-A1 SUBSTITUTED 2-HETEROARYLAMINOBENZENES AND THE SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS Bayer Aktiengesellschaft (DE) 2022-02-09 EP disclosed
WO-2022002838-A1 SUBSTITUTED HETEROARYLOXYPYRIDINES, THE SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2022-01-06 WO disclosed
EP-3911633-A1 HERBICIDAL SUBSTITUTED N-TETRAZOLYL ARYL CARBOXAMIDES Bayer Aktiengesellschaft (DE) 2021-11-24 EP disclosed
WO-2020002087-A1 SUBSTITUTED 3-HETEROARYLOXYPYRIDINES AND SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2020-01-02 WO disclosed
CN-110559446-A Targeted therapeutics 马德里加尔制药公司 2019-12-13 CN disclosed
WO-2019228215-A1 TERNARY HERBICIDAL COMPOSITION AND APPLICATION THEREOF 青岛清原化合物有限公司 (CN) 2019-12-05 WO disclosed
EP-3558975-A1 SUBSTITUTED HETEROARYL PYRROLONES AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES Bayer CropScience Aktiengesellschaft (DE) 2019-10-30 EP disclosed
CN-110072863-A RIP1 kinase inhibitors and methods of use 豪夫迈·罗氏有限公司 2019-07-30 CN disclosed
CN-110023313-A Bicyclic amide compound and its application method 豪夫迈·罗氏有限公司 2019-07-16 CN disclosed
EP-1638944-A1 TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-03-29 EP disclosed
WO-2005000821-A1 TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-01-06 WO disclosed
CN-1335834-A Aromatic heterocyclic compounds having HIV integrase inhibitory activity SHIONOGI & CO (JP) 2002-02-13 CN disclosed
CN-1223653-A Heterocyclic compounds, their preparation and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-07-21 CN disclosed