SCHEMBL151125

SCHEMBL151125

CN(c1cnc(C#N)nc1)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 6/20 0.38
JAK1 P23458 5/20 0.38
JAK2 O60674 2/20 0.38
CTSL P07711 2/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
CTSK P43235 4/20 0.36
CTSS P25774 3/20 0.36
TRPV1 Q8NER1 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
LRRK2 Q5S007 1/20 0.34

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
SCHEMBL154166 0.83 CTSL (0.38) CTSLMCOLN3CTSKCTSS
SCHEMBL153776 0.81 TRPV1 (0.39) JAK3JAK1JAK2MCOLN3CTSK
SCHEMBL155239 0.80 CTSL (0.42) CTSLCTSKCTSS
SCHEMBL27855251 0.73 JAK3 (0.43) JAK3JAK1JAK2TRPV1MEN1
SCHEMBL148917 0.72 MAOA (0.46) JAK3JAK1JAK2MCOLN3TRPV1
SCHEMBL3586485 0.72 CTSS (0.48) JAK3CTSLCTSKCTSSTRPV1
SCHEMBL29324978 0.72 JAK3 (0.53) JAK3JAK1JAK2CTSKLRRK2
SCHEMBL150992 0.72 EGLN2 (0.35) MEN1KMT2A
SCHEMBL4485887 0.69 HRH4 (0.44) JAK3JAK1JAK2TRPV1MEN1
SCHEMBL1238726 0.68 OXTR (0.40) JAK3JAK1JAK2TRPV1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2526149-B1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORP (JP) 2017-03-01 EP disclosed
US-9469710-B2 Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORPORATION (JP) 2016-10-18 US disclosed
US-20150148489-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2015-05-28 US disclosed
US-8735494-B2 Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORPORATION (JP) 2014-05-27 US disclosed
CN-103333275-A Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2013-10-02 CN disclosed
CN-102361887-B Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2013-06-26 CN disclosed
US-20130085227-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2013-04-04 US disclosed
CN-103025816-A Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2013-04-03 CN disclosed
US-8344066-B2 Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORPORATION (JP) 2013-01-01 US disclosed
US-20120296041-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2012-11-22 US disclosed
US-20120059112-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS COMTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2012-03-08 US disclosed