SCHEMBL5531971

SCHEMBL5531971

CC(C)c1ccccc1Pc1ccccc1C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.48
GABRB2 P47870 2/20 0.48
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
FAAH O00519 2/20 0.44
LMNA P02545 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
TSHR P16473 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
GABRB1 P18505 1/20 0.44
PTGS1 P23219 1/20 0.44
SLC6A2 P23975 1/20 0.44
HTR2C P28335 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
HTR2B P41595 1/20 0.44
GABRA2 P47869 1/20 0.44

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
SCHEMBL30884216 1.00 GABRA1 (0.48) GABRA1GABRB2GABRG2GABRB3FAAH
Hydrochloric Acid SCHEMBL2154213 0.97 GABRA1 (0.46) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL14604013 0.87 GABRA1 (0.39) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL28993525 0.86 GABRA1 (0.41) GABRA1GABRB2GABRG2GABRB3FAAH
Hydrochloric Acid SCHEMBL2154870 0.84 GABRA1 (0.40) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL29204723 0.80 GABRA1 (0.44) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL29429205 0.76 GABRA1 (0.63) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL66162 0.76 GABRA1 (0.63) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL2379990 0.75 GABRA1 (0.40) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL7941340 0.75 GABRA1 (0.40) GABRA1GABRB2GABRG2GABRB3FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108031493-B Catalyst system for selective oligomerization of ethylene and ethylene oligomerization reaction method 天津科技大学 2020-11-06 CN claimed
CN-110194937-B Double-sided pressure-sensitive adhesive tape 日东电工株式会社 2022-04-15 CN disclosed
CN-108031493-B Catalyst system for selective oligomerization of ethylene and ethylene oligomerization reaction method 天津科技大学 2020-11-06 CN disclosed
CN-106582851-B Catalytic component and its catalyst for ethylene selectivity oligomerisation 天津科技大学 2019-04-30 CN disclosed
CN-106083927-B Phosphino- amidine compound, metal complex, antigravity system and their oligomeric or olefin polymerization purposes 切弗朗菲利浦化学公司 2018-10-26 CN disclosed
CN-106582851-A Catalyst component for selective oligomerization of ethylene and catalyst thereof 天津科技大学 2017-04-26 CN disclosed
US-9303101-B2 Catalyst for synthesizing polyolefins THE UNIVERSITY OF TOKYO (JP) 2016-04-05 US disclosed
US-9284390-B2 Copolymer of allyl monomer containing polar group THE UNIVERSITY OF TOKYO (JP) 2016-03-15 US disclosed
US-9051399-B2 Method for producing polar group-containing olefin copolymers SHOWA DENKO K.K. (JP) 2015-06-09 US disclosed
US-20150099857-A1 CATALYST FOR SYNTHESIZING POLYOLEFINS SHOWA DENKO K.K. (JP) 2015-04-09 US disclosed
US-20150051361-A1 PRODUCTION METHOD OF COPOLYMER OF ALLYL MONOMER CONTAINING POLAR GROUP SHOWA DENKO K.K. (JP) 2015-02-19 US disclosed
US-8916663-B2 Production method of copolymer of allyl monomer containing polar group THE UNIVERSITY OF TOKYO (JP) 2014-12-23 US disclosed
US-8889805-B2 Carboxylate metal complex and catalyst for olefin polymerization SHOWA DENKO K.K. (JP) 2014-11-18 US disclosed
US-20130165607-A1 METHOD FOR PRODUCING POLAR GROUP-CONTAINING OLEFIN COPOLYMERS SHOWA DENKO K.K. (JP) 2013-06-27 US disclosed
US-20130158223-A1 CARBOXYLATE METAL COMPLEX AND CATALYST FOR OLEFIN POLYMERIZATION THE UNIVERSITY OF TOKYO (JP) 2013-06-20 US disclosed
US-20120116036-A1 PRODUCTION METHOD OF COPOLYMER OF ALLYL MONOMER CONTAINING POLAR GROUP SHOWA DENKO K.K. (JP) 2012-05-10 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 (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-20130158223-A1 CARBOXYLATE METAL COMPLEX AND CATALYST FOR OLEFIN POLYMERIZATION ODC1, AOC2, SCO2 GABRA1 3946/4885GABRB2 3696/4885GABRG2 4038/4885

“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.