SCHEMBL660489

SCHEMBL660489

CCCC(CP(c1ccccc1)c1ccccc1)(CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.33
CYP3A4 P08684 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32
CYP2C19 P33261 1/20 0.32
TP53 P04637 1/20 0.31

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
SCHEMBL15484236 0.96 GAA (0.35) KCNN4CYP3A4TDP1GAAALOX12
SCHEMBL15485001 0.92 KCNN4 (0.31) KCNN4CYP3A4TDP1GAAALOX12
SCHEMBL15484268 0.89 GAA (0.33) TDP1GAAALOX12CYP2C19
SCHEMBL28130666 0.86 GAA (0.36) GAACYP2C19TP53
SCHEMBL5868726 0.85 CYP3A4 (0.38) KCNN4CYP3A4TDP1TP53
SCHEMBL15484304 0.84 GAA (0.34) KCNN4CYP3A4TDP1GAA
SCHEMBL664879 0.83 CYP3A4 (0.36) KCNN4CYP3A4TDP1TP53
SCHEMBL9190778 0.82 CYP3A4 (0.43) KCNN4CYP3A4TDP1GAA
SCHEMBL15485017 0.82 KCNN4 (0.32) KCNN4CYP3A4TDP1GAAALOX12
SCHEMBL27851234 0.82 KCNN4 (0.32) KCNN4CYP3A4TDP1GAAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829248-B2 Method for recovery and recycle of ruthenium homogeneous catalysts EASTMAN CHEMICAL COMPANY (US) 2014-09-09 US claimed
EP-2605856-A1 METHOD FOR RECOVERY AND RECYCLE OF RUTHENIUM HOMOGENEOUS CATALYSTS Eastman Chemical Company (US) 2013-06-26 EP claimed
WO-2012024253-A1 METHOD FOR RECOVERY AND RECYCLE OF RUTHENIUM HOMOGENEOUS CATALYSTS EASTMAN CHEMICAL COMPANY (US) 2012-02-23 WO claimed
US-20120046481-A1 METHOD FOR RECOVERY AND RECYCLE OF RUTHENIUM HOMOGENEOUS CATALYSTS EASTMAN CHEMICAL COMPANY (US) 2012-02-23 US claimed
CN-104203884-B Passivation of homogeneous hydrogenation catalysts for the production of ethylene glycol 伊士曼化工公司 2017-04-05 CN disclosed
CN-103153463-B The method of recovery and recycle of ruthenium homogeneous catalyst EASTMAN CHEMICAL CO. (US) 2015-09-09 CN disclosed
EP-2141142-B1 METHOD FOR PRODUCING ALCOHOL BY HYDROGENATING LACTONE OR CARBOXYLIC ACID ESTER IN LIQUID PHASE TAKASAGO PERFUMERY CO LTD (JP) 2015-03-04 EP disclosed
US-8969632-B2 Passivation of a homogeneous hydrogenation catalyst for the production of ethylene glycol EASTMAN CHEMICAL COMPANY (US) 2015-03-03 US disclosed
CN-104203884-A Passivation of homogeneous hydrogenation catalysts for the production of ethylene glycol EASTMAN CHEM CO 2014-12-10 CN disclosed
US-8829248-B2 Method for recovery and recycle of ruthenium homogeneous catalysts EASTMAN CHEMICAL COMPANY (US) 2014-09-09 US disclosed
US-20130253230-A1 PASSIVATION OF A HOMOGENEOUS HYDROGENATION CATALYST FOR THE PRODUCTION OF ETHYLENE GLYCOL EASTMAN CHEMICAL COMPANY (US) 2013-09-26 US disclosed
EP-2605856-A1 METHOD FOR RECOVERY AND RECYCLE OF RUTHENIUM HOMOGENEOUS CATALYSTS Eastman Chemical Company (US) 2013-06-26 EP disclosed
EP-2141142-A1 METHOD FOR PRODUCING ALCOHOL BY HYDROGENATING LACTONE AND CARBOXYLIC ACID ESTER IN LIQUID PHASE Takasago International Corporation (JP) 2010-01-06 EP disclosed
US-7105590-B2 Phenolfree stabilization of polyolefins CLARIANT FINANCE (BVI) LIMITED (VG) 2006-09-12 US disclosed
US-7083743-B2 Mixture of phosphanes and chromane derivatives CLARIANT FINANCE (BVI) LIMITED (VG) 2006-08-01 US disclosed
US-7067569-B2 Mixtures of phosphorus-containing compounds used as polymer stabilizers CLARIANT FINANCE (BVI) LIMITED (VG) 2006-06-27 US disclosed
EP-1303563-B1 MIXTURES OF PHOSPHORUS-CONTAINING COMPOUNDS USED AS POLYMER STABILISERS CLARIANT FINANCE BVI LTD (VG) 2005-11-02 EP disclosed
EP-1417257-B1 PHENOLFREE STABILIZATION OF POLYOLEFINS CLARIANT FINANCE BVI LTD (VG) 2005-02-09 EP disclosed
US-20040186207-A1 Phenolfree stabilization of polyolefins CLARIANT FINANCE (BVI) LIMITED (VG) 2004-09-23 US disclosed
US-20030187111-A1 Mixtures of phosphorus-containing compounds used as polymer stabilizers CLARIANT FINANCE (BVI) LIMITED (VG) 2003-10-02 US 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 (2 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-20130253230-A1 PASSIVATION OF A HOMOGENEOUS HYDROGENATION CATALYST FOR THE PRODUCTION OF ETHYLENE GLYCOL HPD, TALDO1, GRHPR KCNN4 3036/4885CYP3A4 402/4885TDP1 3630/4885
US-20120046481-A1 METHOD FOR RECOVERY AND RECYCLE OF RUTHENIUM HOMOGENEOUS CATALYSTS GRHPR, DERA, APEH KCNN4 3617/4885CYP3A4 1612/4885TDP1 261/4885

“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.