SCHEMBL29501895

SCHEMBL29501895

O=C(O)C(O)c1ccccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ FABP4 P15090 1/20 0.51
▸ FABP5 Q01469 1/20 0.51
▸ CASP1 P29466 1/20 0.50
▸ ACP3 P15309 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.45
▸ IGFBP3 P17936 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CXCL8 P10145 1/20 0.44
▸ CYP2D6 P10635 1/20 0.43
▸ GLS O94925 1/20 0.42
▸ AOC3 Q16853 1/20 0.42
▸ ADRB2 P07550 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.41
▸ IDO1 P14902 1/20 0.41

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
SCHEMBL28162814 1.00 LMNA (0.52) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL197618 1.00 LMNA (0.52) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL29398319 1.00 LMNA (0.52) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL28162815 1.00 LMNA (0.52) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL29465008 1.00 LMNA (0.52) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL24733 1.00 LMNA (0.52) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL24732 1.00 LMNA (0.52) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL28848826 0.98 LMNA (0.50) LMNAMAPK1FABP4FABP5CASP1
Hydrochloric Acid SCHEMBL1374028 0.98 LMNA (0.50) LMNAMAPK1FABP4FABP5CASP1
SCHEMBL28180751 0.98 LMNA (0.50) LMNAMAPK1FABP4FABP5CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116178202-B (N- (R) -alpha-phenethyl) nitrilotriacetamide and preparation method and application thereof 广西大学 2025-05-06 — — CN claimed
US-20250084395-A1 ENGINEERED NITRILASES FOR BIOCATALYSIS KCAT ENZYMATIC PRIVATE LIMITED (IN) 2025-03-13 — — US claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 — — CN claimed
CN-113754726-B Recombinant enzyme containing polypeptide tag and application thereof in synthesis of medicinal chemicals 浙江工业大学 2024-03-26 — — CN claimed
CN-113801239-B Polypeptide tag, highly soluble recombinant nitrilase and application thereof in synthesis of medicinal chemicals 浙江工业大学 2023-10-20 — — CN claimed
CN-116655652-A New synthesis method of clopidogrel 宿迁盛基医药科技有限公司 2023-08-29 — — CN claimed
CN-116178202-A (N- (R) -alpha-phenethyl) nitrilotriacetamide and preparation method and application thereof 广西大学 2023-05-30 — — CN claimed
WO-2022095221-A1 POLYPEPTIDE TAG, HIGHLY SOLUBLE RECOMBINANT NITRILASE, AND APPLICATION THEREOF IN PHARMACEUTICAL CHEMICAL SYNTHESIS 浙江工业大学 2022-05-12 — — WO claimed
CN-116178202-B (N- (R) -alpha-phenethyl) nitrilotriacetamide and preparation method and application thereof 广西大学 2025-05-06 — — CN disclosed
CN-116178202-B (N- (R) -alpha-phenethyl) nitrilotriacetamide and preparation method and application thereof 广西大学 2025-05-06 — — CN disclosed
US-20250084395-A1 ENGINEERED NITRILASES FOR BIOCATALYSIS KCAT ENZYMATIC PRIVATE LIMITED (IN) 2025-03-13 — — US disclosed
CN-118931887-A Nitrilase cross-linked enzyme aggregate, and preparation method and application thereof 浙江工业大学 2024-11-12 — — CN disclosed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 — — CN disclosed
CN-113355367-B Application of ketoacid reductase in synthesis of chiral aromatic 2-hydroxy acid 浙江工业大学 2024-03-26 — — CN disclosed
WO-2022095221-A1 POLYPEPTIDE TAG, HIGHLY SOLUBLE RECOMBINANT NITRILASE, AND APPLICATION THEREOF IN PHARMACEUTICAL CHEMICAL SYNTHESIS 浙江工业大学 2022-05-12 — — WO disclosed
US-20220135960-A1 POLYPEPTIDE TAG, HIGHLY SOLUBLE RECOMBINANT NITRILASE AND APPLICATION THEREOF IN SYNTHESIS OF PHARMACEUTICAL CHEMICALS ZHEJIANG UNIVERSITY OF TECHNOLOGY (CN) 2022-05-05 — — US disclosed
CN-110172021-B Separation and extraction method of (R) -o-chloromandelic acid 武汉武药制药有限公司 2022-04-22 — — CN disclosed
CN-110183355-B Refining method of high-purity o-chloro mandelonitrile 武汉武药制药有限公司 2022-04-22 — — CN disclosed
US-20220113247-A1 QUANTITATIVE AUXILIARY-FREE CHIRALITY SENSING WITH A METAL PROBE GEORGETOWN UNIVERSITY 2022-04-14 — — US disclosed
CN-109867685-B Preparation method of clopidogrel hydrogen sulfate II type 武汉武药制药有限公司 2022-04-08 — — CN disclosed
Send feedback