SCHEMBL148400

SCHEMBL148400

C[Si]1(C)CCCN1c1ccc(C#N)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.42
CHRNA10 Q9GZZ6 1/20 0.40
CHRNA9 Q9UGM1 1/20 0.40
POLB P06746 1/20 0.38
CYP2A6 P11509 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.35
KCNH2 Q12809 2/20 0.35
KCNJ1 P48048 1/20 0.35
ELANE P08246 1/20 0.35
HRH3 Q9Y5N1 8/20 0.35
CHEK1 O14757 1/20 0.35
NOTUM Q6P988 1/20 0.33

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
SCHEMBL152275 0.81 DRD2 (0.49) ALDH1A1KCNH2NOTUM
SCHEMBL149717 0.76 USP14 (0.35) CHEK1
SCHEMBL150969 0.74 KDM4E (0.43) KDM4ETP53CHRNA10CHRNA9POLB
SCHEMBL148508 0.73 PANK3 (0.33)
SCHEMBL156258 0.72 CYP19A1 (0.42) CYP2A6LOXL2KCNH2KCNJ1HRH3
SCHEMBL150124 0.70 KDM4E (0.39) KDM4EALDH1A1NOTUM
SCHEMBL154178 0.67 KDM4E (0.68) KDM4ETP53CHRNA10CHRNA9POLB
SCHEMBL7402909 0.67 KDM4E (0.68) KDM4ETP53CHRNA10CHRNA9POLB
SCHEMBL2384959 0.66 KDM4E (0.80) KDM4ETP53CHRNA10CHRNA9POLB
SCHEMBL139427 0.66 KDM4E (0.66) KDM4ETP53CHRNA10CHRNA9POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735494-B2 Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORPORATION (JP) 2014-05-27 US disclosed
US-20130085227-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2013-04-04 US disclosed
US-8344066-B2 Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORPORATION (JP) 2013-01-01 US disclosed
US-20120059112-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS COMTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2012-03-08 US disclosed
EP-2382240-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP Bridgestone Corporation (JP) 2011-11-02 EP disclosed
WO-2010085622-A9 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-12-23 WO disclosed
WO-2010085622-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-07-29 WO disclosed