SCHEMBL727947

SCHEMBL727947

C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.34
PTPRC P08575 1/20 0.34
PTPRF P10586 1/20 0.34
CDC25B P30305 1/20 0.34
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL28887375 1.00 PTPN1 (0.34) PTPN1PTPRCPTPRFCDC25BMEN1
SCHEMBL29860849 0.84 PTPN1 (0.35) PTPN1PTPRCPTPRFCDC25BMEN1
SCHEMBL29555282 0.82 PTPN1 (0.47) PTPN1PTPRCPTPRFCDC25BALDH1A1
SCHEMBL19547127 0.78 PTPN1 (0.37) PTPN1PTPRCPTPRFCDC25BMEN1
SCHEMBL994818 0.78 PTPN1 (0.37) PTPN1PTPRCPTPRFCDC25BMEN1
Hydrochloric Acid SCHEMBL4450657 0.77 PTPN1 (0.36) PTPN1PTPRCPTPRFCDC25BMEN1
Hydrochloric Acid SCHEMBL994817 0.77 PTPN1 (0.36) PTPN1PTPRCPTPRFCDC25BMEN1
SCHEMBL4744729 0.76 CYP3A4 (0.40) PTPN1PTPRCPTPRFCDC25BALDH1A1
SCHEMBL28981793 0.73 PTGS2 (0.32)
Biphenyl SCHEMBL28193720 0.73 ALDH1A1 (0.43) MEN1KMT2AALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018333-A1 Producing Recycled Carbon Black from Waste Tires EXXONMOBIL TECHNOLOGY & ENGINEERING COMPANY (US) 2024-01-18 US claimed
EP-3126407-B1 SPACER GROUPS FOR FUNCTIONALIZED RESINS IN TIRES EXXONMOBIL CHEMICAL PATENTS INC (US) 2022-08-03 EP claimed
EP-3077433-B1 FUNCTIONALIZED RESINS FOR HIGH PERFORMANCE TIRES EXXONMOBIL CHEMICAL PATENTS INC (US) 2022-04-20 EP claimed
US-10384987-B2 1,3-butadiene synthesis ARLANXEO DEUTSCHLAND GMBH (DE) 2019-08-20 US claimed
EP-3233768-B1 1,3-BUTADIENE SYNTHESIS ARLANXEO DEUTSCHLAND GMBH (DE) 2019-02-20 EP claimed
EP-3099654-B1 SYNTHETIC METHOD UNIV COURT UNIV ST ANDREWS (GB) 2018-05-09 EP claimed
EP-2771339-B1 IMPROVED PROCESS FOR PREPARING AN INTERMEDIATE OF THE MACROCYCLIC PROTEASE INHIBITOR TMC 435 JANSSEN PHARMACEUTICALS INC (US) 2018-04-18 EP claimed
US-9908826-B2 Synthetic method UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2018-03-06 US claimed
US-9840569-B2 Spacer groups for functionalized resins in tires EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-12-12 US claimed
US-20170327436-A1 1,3-BUTADIENE SYNTHESIS ARLANXEO DEUTSCHLAND GMBH (DE) 2017-11-16 US claimed
US-20130030126-A1 Olefin Functionalization By Metathesis Reaction EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-01-31 US claimed
US-8283419-B2 Olefin functionalization by metathesis reaction EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-10-09 US claimed
WO-2012134722-A2 DIBLOCK COPOLYMERS PREPARED BY CROSS METATHESIS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-10-04 WO claimed
US-20120245294-A1 Olefin Triblock Polymers via Ring-Opening Metathesis Polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2012-09-27 US claimed
US-20120245290-A1 Diblock Copolymers Prepared by Cross Metathesis EXXONMOBIL CHEMICAL PATENTS INC. 2012-09-27 US claimed
JP-2011525213-A 2011-09-15 JP claimed
EP-2318446-A2 OLEFIN FUNCTIONALIZATION BY METATHESIS REACTION ExxonMobil Chemical Patents Inc. (US) 2011-05-11 EP claimed
WO-2009155517-A2 OLEFIN FUNCTIONALIZATION BY METATHESIS REACTION EXXONMOBIL CHEMICAL PATENT INC. (US) 2009-12-23 WO claimed
WO-2006110471-A2 MICROPOROUS POLYDICYCLOPENDIENE-BASED AEROGELS ASPEN AEROGELS, INC. (US) 2006-10-19 WO claimed
US-20060229374-A1 MICROPOROUS POLYDICYCLOPENDIENE-BASED AEROGELS MIDCAP FUNDING IV TRUST 2006-10-12 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-10384987-B2 1,3-butadiene synthesis SQLE, FDFT1, ENO1 PTPN1 4601/4885PTPRC 4573/4885PTPRF 4451/4885
US-20170327436-A1 1,3-BUTADIENE SYNTHESIS SQLE, FDFT1, ENO1 PTPN1 4601/4885PTPRC 4573/4885PTPRF 4451/4885
US-20130030126-A1 Olefin Functionalization By Metathesis Reaction MAX, AP1M1, AP3M1 PTPN1 4144/4885PTPRC 3276/4885PTPRF 2524/4885

“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.