Alcohol

Alcohol

SCHEMBL7540710

C1=CC([Zr]2(C3C=CC4=C3CCCC4)CC2)C2=C1CCCC2.CCO

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL812615 0.89
SCHEMBL10607100 0.89
SCHEMBL8420767 0.89
Hydrochloric Acid SCHEMBL60123 0.88
Bromide SCHEMBL6904659 0.88
Fluoride SCHEMBL7595461 0.88
Hydrochloric Acid SCHEMBL2877935 0.88
Hydrochloric Acid SCHEMBL10456231 0.88
Hydrochloric Acid SCHEMBL10456417 0.88
Hydrochloric Acid SCHEMBL5599450 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0294942-B2 Solid catalyst for polymerizing an olefin MITSUI CHEMICALS INC (JP) 2002-05-08 EP disclosed
EP-0314797-B1 OLEFIN POLYMERIZATION CATALYST AND PROCESS FOR POLYMERIZING OLEFIN MITSUI PETROCHEMICAL IND (JP) 1997-07-02 EP disclosed
EP-0294942-B1 Solid catalyst for polymerizing an olefin MITSUI PETROCHEMICAL IND (JP) 1994-07-13 EP disclosed
US-5206199-A Transition metal compound, aluminoxane, organoaluminum compound narrow weight distribution, high bulk density MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-04-27 US disclosed
US-5126301-A Organometallic compound, aluminoxane, group 4 metal compound, and olefin polymer MITSUI PETROCHEMICAL INDUSTRIES, INC. (JP) 1992-06-30 US disclosed
US-5122491-A Coordination catalysts; synergistic effect of aluminoxane and organoaluminum compound MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-06-16 US disclosed
EP-0314797-A1 OLEFIN POLYMERIZATION CATALYST AND PROCESS FOR POLYMERIZING OLEFIN MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-05-10 EP disclosed
EP-0294942-A1 Solid catalyst for polymerizing an olefin MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-12-14 EP disclosed