SCHEMBL2230128

SCHEMBL2230128

C/C(=C/C#N)Nc1ccccc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ SIGMAR1 Q99720 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ RECQL P46063 1/20 0.44
▸ EPHX1 P07099 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ ITGB3 P05106 1/20 0.42
▸ ITGB1 P05556 1/20 0.42
▸ ITGAV P06756 1/20 0.42
▸ ITGA5 P08648 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ EGFR P00533 1/20 0.41
▸ MMP1 P03956 1/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ MMP9 P14780 1/20 0.41

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
SCHEMBL22787322 0.79 HPGD (0.61) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL2229911 0.78 ALDH1A1 (0.47) ALDH1A1SIGMAR1GAAL3MBTL1POLB
SCHEMBL24653597 0.76 HPGD (0.53) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL13767805 0.76 MAPT (0.52) HPGDALDH1A1NPC1RAB9AGAA
SCHEMBL27855264 0.76 MAPT (0.52) HPGDALDH1A1NPC1RAB9AGAA
SCHEMBL17885425 0.73 MAPT (0.69) HPGDALDH1A1NPC1RAB9AGAA
SCHEMBL24611544 0.72 HPGD (0.49) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL29110388 0.71 HPGD (0.61) HPGDALDH1A1NPC1RAB9AGAA
SCHEMBL13236107 0.70 RAB9A (0.62) HPGDALDH1A1NPC1RAB9AEPHX1
SCHEMBL10192084 0.70 TDP1 (0.48) ALDH1A1NPC1RAB9AGAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-103025816-A Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2013-04-03 — — CN disclosed
CN-102361887-A Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2012-02-22 — — CN disclosed
EP-2382240-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP Bridgestone Corporation (JP) 2011-11-02 — — EP disclosed
WO-2011091346-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2011-07-28 — — WO 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
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