SCHEMBL245405

SCHEMBL245405

Cc1ccc(C(O)C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.62
MAPK1 P28482 1/20 0.62
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
BLM P54132 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TSHR P16473 1/20 0.47
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ACHE P22303 1/20 0.42
ALOX5 P09917 1/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
POLB P06746 1/20 0.42
SRD5A2 P31213 1/20 0.41
HPGD P15428 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
PSMB5 P28074 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
SCHEMBL366066 1.00 LMNA (0.62) LMNAMAPK1KEAP1NFE2L2BLM
SCHEMBL245404 1.00 LMNA (0.62) LMNAMAPK1KEAP1NFE2L2BLM
SCHEMBL11835765 0.94 LMNA (0.56) LMNAMAPK1KEAP1NFE2L2BLM
D-Alanine SCHEMBL11208357 0.90 LMNA (0.52) LMNAMAPK1KEAP1NFE2L2BLM
D-Alanine SCHEMBL11207612 0.90 LMNA (0.52) LMNAMAPK1KEAP1NFE2L2BLM
Alanine SCHEMBL11209772 0.90 LMNA (0.52) LMNAMAPK1KEAP1NFE2L2BLM
Alanine SCHEMBL11204313 0.90 LMNA (0.52) LMNAMAPK1KEAP1NFE2L2BLM
D-Alanine SCHEMBL11496478 0.88 LMNA (0.50) LMNAMAPK1KEAP1NFE2L2BLM
SCHEMBL275597 0.87 LMNA (0.79) LMNAMAPK1BLMNPSR1TSHR
SCHEMBL9000789 0.81 LMNA (0.62) LMNAMAPK1BLMNPSR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-20220281839-A1 BENZIMIDAZOLE DERIVATIVES AS DUAL HISTAMINE H1 AND HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET SOC CIV (FR) 2022-09-08 US claimed
CN-113355299-B Ketoacid reductase, gene, engineering bacterium and application in synthesis of chiral aromatic 2-hydroxy acid 浙江工业大学 2022-05-24 CN claimed
US-11306069-B2 Benzimidazole derivatives as dual histamine H1 and histamine H4 receptor ligands BIOPROJET (FR) 2022-04-19 US claimed
CN-113355299-A Ketoacid reductase, gene, engineering bacterium and application in synthesis of chiral aromatic 2-hydroxy acid 浙江工业大学 2021-09-07 CN claimed
CN-113355367-A Application of ketoacid reductase in synthesis of chiral aromatic 2-hydroxy acid 浙江工业大学 2021-09-07 CN claimed
CN-108410831-B Ketoacid reductase, gene, engineering bacterium and application in synthesis of chiral aromatic 2-hydroxy acid 浙江工业大学 2021-07-27 CN claimed
EP-3486243-B1 BENZIMIDAZOLE DERIVATIVES AS DUAL HISTAMINE H1 AND HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET SOC CIV (FR) 2020-04-15 EP claimed
CN-107339183-B Fuel injector for internal combustion engine 通用汽车环球科技运作有限责任公司 2019-10-22 CN claimed
EP-3486243-A1 BENZIMIDAZOLE DERIVATIVES AS DUAL HISTAMINE H1 AND HISTAMINE H4 RECEPTOR LIGANDS Bioprojet (FR) 2019-05-22 EP claimed
CN-107339183-A Fuel injector for explosive motor 通用汽车环球科技运作有限责任公司 2017-11-10 CN claimed
CN-102660471-B Production of chiral alpha-hydroxy acid and its strain by using biological catalysis method UNIV ZHEJIANG TECHNOLOGY 2014-11-05 CN claimed
CN-102660470-B Sinorhizobium fredii and its application in producing chiral alpha-hydroxy acid by biologically splitting alpha-hydroxy acid raceme UNIV ZHEJIANG TECHNOLOGY 2013-07-31 CN claimed
CN-102660471-A Production of chiral alpha-hydroxy acid and its strain by using biological catalysis method UNIV ZHEJIANG TECHNOLOGY 2012-09-12 CN claimed
CN-102660470-A Sinorhizobium fredii and its application in producing chiral alpha-hydroxy acid by biologically splitting alpha-hydroxy acid raceme UNIV ZHEJIANG TECHNOLOGY 2012-09-12 CN claimed
US-7985572-B2 Modified nitrilases and their use in methods for the production of carboxylic acids BASF SE (DE) 2011-07-26 US claimed
CN-101911914-A Culture medium for spore germination and seedling culturing of pteridophyte UNIV CHINA GEOSCIENCES WUHAN 2010-12-15 CN claimed
EP-1599584-B1 MODIFIED NITRILASES AND THEIR USE IN METHODS FOR THE PRODUCTION OF CARBOXYLIC ACIDS BASF SE (DE) 2009-07-01 EP claimed
US-20070112216-A1 Method for producing chiral mercapto amino acids DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) 2007-05-17 US claimed
US-20060259999-A1 Modified nitrilases and their use in methods for the production of carboxylic acids BASF AKTIENGESELLSCHAFT (DE) 2006-11-16 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20070112216-A1 Method for producing chiral mercapto amino acids CPN1, AKR1C3, AHCY LMNA 1994/4885MAPK1 2896/4885KEAP1 1368/4885
US-20220281839-A1 BENZIMIDAZOLE DERIVATIVES AS DUAL HISTAMINE H1 AND HISTAMINE H4 RECEPTOR LIGANDS HRH4, HRH3, HRH1 LMNA 4626/4885MAPK1 3796/4885KEAP1 1128/4885
US-11306069-B2 Benzimidazole derivatives as dual histamine H1 and histamine H4 receptor ligands HRH4, HRH3, HRH1 LMNA 4746/4885MAPK1 3692/4885KEAP1 1280/4885

“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.