SCHEMBL3673710

SCHEMBL3673710

CCCCC(C#N)CCC

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
DNM1 Q05193 2/20 0.38
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 1/20 0.32
FDPS P14324 1/20 0.32
LMNA P02545 1/20 0.32
CA2 P00918 2/20 0.31
MAPK1 P28482 1/20 0.31
OPRM1 P35372 1/20 0.31
CA1 P00915 1/20 0.30
THRB P10828 1/20 0.30

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
SCHEMBL3677002 0.94 TSHR (0.50) TSHRDNM1ALDH1A1TDP1SMN1; SMN2
SCHEMBL2182376 0.92 TSHR (0.43) TSHRDNM1FDPSLMNAOPRM1
SCHEMBL20530377 0.92 TSHR (0.43) TSHRDNM1FDPSLMNAOPRM1
SCHEMBL30879536 0.92 TSHR (0.43) TSHRDNM1FDPSLMNAOPRM1
SCHEMBL532758 0.91
SCHEMBL16760715 0.90 TSHR (0.42) TSHRDNM1FDPSLMNAOPRM1
SCHEMBL3451185 0.90 TSHR (0.42) TSHRDNM1FDPSLMNAOPRM1
SCHEMBL10167940 0.90 TSHR (0.42) TSHRDNM1FDPSLMNAOPRM1
SCHEMBL11153202 0.90 TSHR (0.42) TSHRDNM1FDPSLMNAOPRM1
SCHEMBL31294445 0.90 TSHR (0.42) TSHRDNM1FDPSLMNAOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115505053-A Hydrogenated butadiene-valeronitrile rubber and preparation method and application thereof 中国科学院青岛生物能源与过程研究所 2022-12-23 CN claimed
CN-100475856-C Arylsulfinate salts in photoinitiator systems for polymerization reactions 3M INNOVATIVE PROPERTIES CO (US) 2009-04-08 CN claimed
CN-1860135-A Arylsulfinate salts in photoinitiator systems for polymerization reactions 3M INNOVATIVE PROPERTIES CO (US) 2006-11-08 CN claimed
EP-3809506-B1 LITHIUM ION BATTERY AND DEVICE CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-12-13 EP disclosed
CN-115505053-A Hydrogenated butadiene-valeronitrile rubber and preparation method and application thereof 中国科学院青岛生物能源与过程研究所 2022-12-23 CN disclosed
CN-115505053-A Hydrogenated butadiene-valeronitrile rubber and preparation method and application thereof 中国科学院青岛生物能源与过程研究所 2022-12-23 CN disclosed
CN-115477726-A Modified butadiene-valeronitrile rubber with extremely high nitrile content as well as preparation method and application thereof 中国科学院青岛生物能源与过程研究所 2022-12-16 CN disclosed
EP-3809506-A1 LITHIUM ION BATTERY AND DEVICE Contemporary Amperex Technology Co., Limited (CN) 2021-04-21 EP disclosed
US-10597356-B2 Process for the catalytic reversible alkene-nitrile interconversion STUDIENGESELLSCHAFT KOHLE MBH (DE) 2020-03-24 US disclosed
US-20190031602-A1 PROCESS FOR THE CATALYTIC REVERSIBLE ALKENE-NITRILE INTERCONVERSION STUDIENGESELLSCHAFT KOHLE MBH (DE) 2019-01-31 US disclosed
WO-2017093149-A1 Process for the Catalytic Reversible Alkene-Nitrile Interconversion STUDIENGESELLSCHAFT KOHLE MBH (DE) 2017-06-08 WO disclosed
US-7714087-B2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2010-05-11 US disclosed
US-20090137757-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof IMUTA JUNICHI 2009-05-28 US disclosed
CN-100475856-C Arylsulfinate salts in photoinitiator systems for polymerization reactions 3M INNOVATIVE PROPERTIES CO (US) 2009-04-08 CN disclosed
CN-100475855-C Arylsulfinate salts in initiator systems for polymeric reactions 3M INNOVATIVE PROPERTIES CO (US) 2009-04-08 CN disclosed
CN-1860135-A Arylsulfinate salts in photoinitiator systems for polymerization reactions 3M INNOVATIVE PROPERTIES CO (US) 2006-11-08 CN disclosed
CN-1859894-A Dental compositions and methods with arylsulfinate salts 3M INNOVATIVE PROPERTIES CO (US) 2006-11-08 CN disclosed
CN-1860134-A Arylsulfinate salts in initiator systems for polymeric reactions 3M INNOVATIVE PROPERTIES CO (US) 2006-11-08 CN disclosed
EP-1668039-A1 ARYLSULFINATE SALTS IN PHOTOINITIATOR SYSTEMS FOR POLYMERIZATION REACTIONS 3M Innovative Properties Company (US) 2006-06-14 EP disclosed
WO-2005035591-A1 ARYLSULFINATE SALTS IN PHOTOINITIATOR SYSTEMS FOR POLYMERIZATION REACTIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-04-21 WO 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-20190031602-A1 PROCESS FOR THE CATALYTIC REVERSIBLE ALKENE-NITRILE INTERCONVERSION HCN2, HCN1, HCN4 TSHR 4174/4885DNM1 3887/4885ALDH1A1 939/4885
US-10597356-B2 Process for the catalytic reversible alkene-nitrile interconversion HCN2, HCN1, HCN4 TSHR 4174/4885DNM1 3887/4885ALDH1A1 939/4885

“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.