SCHEMBL1749008

SCHEMBL1749008

CC(C)(C)OC(=O)NC(Cc1ccc(Cl)cc1Cl)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.55
ACE P12821 2/20 0.52
PPARA Q07869 3/20 0.52
PPARG P37231 2/20 0.52
TP53 P04637 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
IDO1 P14902 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
PKM P14618 1/20 0.50
HPGD P15428 1/20 0.50
ALOX12 P18054 1/20 0.50
CTSL P07711 1/20 0.50
SCN9A Q15858 1/20 0.47
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
PTPN1 P18031 1/20 0.45
CTSS P25774 3/20 0.45

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
SCHEMBL1614505 1.00 MC4R (0.55) MC4RACEPPARAPPARGTP53
SCHEMBL29726536 1.00 MC4R (0.55) MC4RACEPPARAPPARGTP53
SCHEMBL4288943 1.00 MC4R (0.55) MC4RACEPPARAPPARGTP53
SCHEMBL23357004 0.89 ACE (0.51) MC4RACEPPARAPPARGCTSL
SCHEMBL2796961 0.89 PPARA (0.51) MC4RACEPPARAPPARGTP53
SCHEMBL23357002 0.89 ACE (0.51) MC4RACEPPARAPPARGCTSL
SCHEMBL12737917 0.89 PPARA (0.51) MC4RACEPPARAPPARGTP53
SCHEMBL5319509 0.88 ACE (0.50) MC4RACEPPARAPPARGCTSL
SCHEMBL5321402 0.88 CTSS (0.53) MC4RACEPPARAPPARGTP53
SCHEMBL12737973 0.88 CTSS (0.53) MC4RACEPPARAPPARGTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016029146-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON (US) 2016-02-25 WO claimed
US-20240057599-A1 METHODS FOR IMPROVING FRUIT QUALITY THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2024-02-22 US disclosed
US-11812746-B2 Method of controlling fungal infections in plants THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2023-11-14 US disclosed
CN-108752241-B Acylguanidines for the treatment of arthrosis 默克专利股份公司 2021-03-12 CN disclosed
US-10913736-B2 Specific inhibitors of methionyl-tRNA synthetase UNIVERSITY OF WASHINGTON (US) 2021-02-09 US disclosed
US-20200383327-A1 METHOD OF IMPROVING PLANT PERFORMANCE THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2020-12-10 US disclosed
CN-105102424-B Acylguanidines for the treatment of arthrosis 默克专利股份公司 2020-09-11 CN disclosed
US-20190246639-A1 METHOD OF CONTROLLING FUNGAL INFECTIONS IN PLANTS THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCHORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2019-08-15 US disclosed
US-9884814-B2 Acylguanidines for treating osteoarthritis MERCK PATENT GMBH (DE) 2018-02-06 US disclosed
US-20170275279-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON 2017-09-28 US disclosed
WO-2007021990-A2 MELANOCORTIN RECEPTOR-SPECIFIC PIPERAZINE COMPOUNDS WITH DIAMINE GROUPS PALATIN TECHNOLOGIES, INC. (US) 2007-02-22 WO disclosed
US-20060287331-A1 MELANOCORTIN RECEPTOR-SPECIFIC PIPERAZINE COMPOUNDS WITH DIAMINE GROUPS PALATIN TECHNOLOGIES, INC. (US) 2006-12-21 US disclosed
US-20060287332-A1 Melanocortin Receptor-Specific Piperazine and Keto-Piperazine Compounds PALATIN TECHNOLOGIES, INC. (US) 2006-12-21 US disclosed
WO-2006036670-A1 SULFONAMIDE COMPOUNDS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-04-06 WO disclosed
US-20060069286-A1 Sulfonamide compounds JANSSEN PHARMACEUTICA, N.V. (BE) 2006-03-30 US disclosed
US-20040192676-A1 Ligands of melanocortin receptors and compositions and methods related thereto NEUROCRINE BIOSCIENCES, INC. 2004-09-30 US disclosed
WO-2004058735-A2 LIGANDS OF MELANOCORTIN RECEPTORS AND COMPOSITIONS AND METHODS RELATED THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2004-07-15 WO disclosed
US-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
US-6114310-A THERAPY FOR MICROBIAL INFECTIONS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-09-05 US disclosed
WO-1999037667-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 1999-07-29 WO disclosed

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

For each of this compound's patents that has machine-readable text (6 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-20040192676-A1 Ligands of melanocortin receptors and compositions and methods related thereto MC3R, MC1R, MC2R MC4R 5/4885ACE 3595/4885PPARA 1876/4885
US-20170275279-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE AARS1, MTR, GARS1 MC4R 1459/4885ACE 3083/4885PPARA 3931/4885
US-20060287332-A1 Melanocortin Receptor-Specific Piperazine and Keto-Piperazine Compounds MC4R, MC5R, MC1R MC4R 1/4885ACE 4330/4885PPARA 269/4885
US-10913736-B2 Specific inhibitors of methionyl-tRNA synthetase AARS1, MTR, GARS1 MC4R 1459/4885ACE 3083/4885PPARA 3931/4885
US-20060069286-A1 Sulfonamide compounds CCKAR, CCKBR, TAS1R2 MC4R 1142/4885ACE 3146/4885PPARA 1419/4885
US-20060287331-A1 MELANOCORTIN RECEPTOR-SPECIFIC PIPERAZINE COMPOUNDS WITH DIAMINE GROUPS MC4R, MC1R, MC5R MC4R 1/4885ACE 3994/4885PPARA 441/4885

“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.