SCHEMBL5035850

SCHEMBL5035850

CCCCCCCCCCCCC(C)(C)[C]=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.41
FDPS P14324 9/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
SMPD1 P17405 2/20 0.39
CES2 O00748 1/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39

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
SCHEMBL2368059 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL5497688 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL8176550 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL5497444 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL1410606 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL424188 0.97 FDPS (0.38) GGPS1FDPSSMPD1CES2LPAR1
SCHEMBL1410618 0.90
SCHEMBL8906809 0.88 FAAH (0.50)
SCHEMBL10530613 0.81 FDPS (0.30) FDPS
SCHEMBL7722417 0.80 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0662965-A1 1,2-DISUBSTITUTED ETHYL AMIDES AS INHIBITORS OF ACAT SCHERING CORPORATION (US) 1995-07-19 EP claimed
US-5321031-A Treating cardiovascular disorders SCHERING CORPORATION (US) 1994-06-14 US claimed
WO-1994006784-A1 1,2-DISUBSTITUTED ETHYL AMIDES AS INHIBITORS OF ACAT SCHERING CORPORATION (US) 1994-03-31 WO claimed
EP-1204677-B1 CYCLOHEXAPEPTIDE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS A PHARMACEUTICAL AVENTIS PHARMA GMBH (DE) 2008-12-03 EP disclosed
EP-1095947-B1 NOVEL ANTIBACTERIAL COMPOUNDS SANKYO CO (JP) 2007-03-14 EP disclosed
US-7166572-B1 Cyclohexapeptide compounds, processes for their production and their use as a pharmaceutical AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2007-01-23 US disclosed
US-6844173-B2 Strain of Streptomyces griseus SANKYO COMPANY, LIMITED (JP) 2005-01-18 US disclosed
EP-1319406-A1 Novel antibacterial compounds Sankyo Company, Limited (JP) 2003-06-18 EP disclosed
US-20030069204-A1 Strain of streptomyces SANKYO COMPANY LIMITED (JP) 2003-04-10 US disclosed
US-6472384-B1 Antimicrobial compounds SANKYO COMPANY, LIMITED (JP) 2002-10-29 US disclosed
EP-1095947-A1 NOVEL ANTIBACTERIAL COMPOUNDS Sankyo Company Limited (JP) 2001-05-02 EP disclosed
US-5854212-A Cyclohexapeptidyl bisamine compound, compositions containing said compound and methods of use MERCK & CO., INC. (US) 1998-12-29 US disclosed
EP-0862579-A1 CYCLOHEXAPEPTIDYL BISAMINE COMPOUND, COMPOSITIONS CONTAINING SAID COMPOUND AND METHODS OF USE Merck & Co., Inc. (US) 1998-09-09 EP disclosed
WO-1997017365-A1 CYCLOHEXAPEPTIDYL BISAMINE COMPOUND, COMPOSITIONS CONTAINING SAID COMPOUND AND METHODS OF USE MERCK & CO., INC. (US) 1997-05-15 WO disclosed
US-5607931-A AMIDES SCHERING CORPORATION (US) 1997-03-04 US disclosed
EP-0662965-A1 1,2-DISUBSTITUTED ETHYL AMIDES AS INHIBITORS OF ACAT SCHERING CORPORATION (US) 1995-07-19 EP disclosed
US-5321031-A Treating cardiovascular disorders SCHERING CORPORATION (US) 1994-06-14 US disclosed
WO-1994006784-A1 1,2-DISUBSTITUTED ETHYL AMIDES AS INHIBITORS OF ACAT SCHERING CORPORATION (US) 1994-03-31 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 (1 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-20030069204-A1 Strain of streptomyces O60361, CYP8B1, MRPS34 GGPS1 147/4885FDPS 415/4885TSHR 3757/4885

“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.