SCHEMBL2573007

SCHEMBL2573007

CCCCCCC(C)(OC)OC

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
GGPS1 O95749 6/20 0.38
SMPD1 P17405 5/20 0.38
FDPS P14324 9/20 0.37
CES2 O00748 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR3 Q9UBY5 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
SCHEMBL14778378 1.00 TSHR (0.42) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL12336367 1.00 TSHR (0.42) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL3249837 1.00 TSHR (0.42) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL14778439 1.00 TSHR (0.42) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL14778077 1.00 TSHR (0.42) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL4451444 0.97 TSHR (0.37) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL6160701 0.89 TSHR (0.36) TSHRTHRBFDPS
Hydrochloric Acid SCHEMBL9418676 0.84 HTT (0.56)
Methyl Nonyl Ketone SCHEMBL21328499 0.82 CES1 (0.42) TSHRCES2
SCHEMBL95578 0.79 TSHR (0.46) TSHRTHRBGGPS1SMPD1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1140349-C Catalyst for conversion of ethylene into light alpha olefins 2004-03-03 CN claimed
EP-0860411-B1 Improved catalytic composition for the conversion of ethylene to alpha olefins INST FRANCAIS DU PETROLE (FR) 2003-10-29 EP claimed
CN-1107545-C Improved catalytic composition and process for converting ethylene to light alpha olefins INST FRANCAIS DU PETROLE (FR) 2003-05-07 CN claimed
US-6221986-B1 CATALYTIC OLIGOMERIZATION INSTITUT FRANCAIS DU PETROLE (FR) 2001-04-24 US claimed
US-6103654-A Catalytic composition and a process for converting ethylene to light alpha olefins INSTITUT FRANCAIS DU PETROLE (FR) 2000-08-15 US claimed
CN-1047374-C Process for converting ethylene to light alpha-olefins INST FRANCAIS DU PETROLE (FR) 1999-12-15 CN claimed
CN-1229696-A Catalyst for conversion of ethylene into light alpha olefins INST FRANCAIS DU PETROLE (FR) 1999-09-29 CN claimed
CN-1195580-A Improved catalytic composition and process for converting ethylene to light alpha olefins INST FRANCAIS DU PETROLE (FR) 1998-10-14 CN claimed
EP-0578541-B1 Process for the preparation of light alpha-olefines by oligomerisation of ethylene INST FRANCAIS DU PETROLE (FR) 1997-12-03 EP claimed
US-5496783-A CATALYSIS WITH MIXTURE OF ZIRCONIUM COMPOUND, ACETAL OR KETAL, AND ORGANOALUMINUM BROMIDE OR CHLORIDE INSTITUT FRANCAIS DU PETROLE (FR) 1996-03-05 US claimed
US-5345023-A Zirconium coordination catalysts with acetals and ketals INSTITUT FRANCAIS DU PETROLE (FR) 1994-09-06 US claimed
CN-1083465-A Method for producing light alpha olefin by ethylene oligomerization INST FRANCAIS DU PETROLE (FR) 1994-03-09 CN claimed
JP-4095039-A None JP disclosed
CN-103012628-A Solid catalyst for olefin polymerization and process for producing olefin polymer SUMITOMO CHEMICAL CO 2013-04-03 CN disclosed
US-20130072648-A1 SOLID CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-21 US disclosed
US-20120289502-A1 IMIDAZOLE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-11-15 US disclosed
EP-0045524-B1 22-ARYLSULFONYL-24,25-DIHYDROXYCHOLESTANES AND PROCESS FOR PREPARING THE SAME Chugai Seiyaku Kabushiki Kaisha (JP) 1983-10-19 EP disclosed
EP-0060077-A1 Beta-lactam antibiotics, their preparation and use BEECHAM GROUP PLC (GB) 1982-09-15 EP disclosed
US-4344888-A 24,25-Dihydroxycholestans and process for preparing the same CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1982-08-17 US disclosed
EP-0045524-A1 22-Arylsulfonyl-24,25-dihydroxycholestanes and process for preparing the same Chugai Seiyaku Kabushiki Kaisha (JP) 1982-02-10 EP 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-20120289502-A1 IMIDAZOLE DERIVATIVES CNR1, CNR2, ARRB1 TSHR 478/4885THRB 481/4885GGPS1 2707/4885

“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.