SCHEMBL27835477

SCHEMBL27835477

CCCCCCCCC(C[N+](C)(C)C)OP(=O)(O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.59
PTPN1 P18031 1/20 0.48
FDPS P14324 3/20 0.46
S1PR2 O95136 5/20 0.44
S1PR1 P21453 5/20 0.44
S1PR3 Q99500 5/20 0.44
S1PR4 O95977 4/20 0.44
MAPK1 P28482 2/20 0.43
CYP1A2 P05177 2/20 0.43
LAP3 P28838 1/20 0.43
MEN1 O00255 1/20 0.43
GMNN O75496 1/20 0.43
LMNA P02545 1/20 0.43
HSP90AA1 P07900 1/20 0.43
MAPT P10636 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL1044719 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL596695 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL744377 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL5481597 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL27542771 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL27699114 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
Water SCHEMBL27411638 0.98 SMPD1 (0.57) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL8160746 0.98 SMPD1 (0.56) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL4064805 0.91 SMPD1 (0.50) SMPD1PTPN1S1PR2S1PR1S1PR3
SCHEMBL3332099 0.91 SMPD1 (0.50) SMPD1PTPN1S1PR2S1PR1S1PR3

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
CN-107735430-A Method for producing rubber particles bonded to membrane-bound protein, method for producing pneumatic tire, and method for producing rubber product 住友橡胶工业株式会社 2018-02-23 CN disclosed
CN-107709565-A Polyisoprenoid, vector, method for producing transgenic plant, method for producing pneumatic tire, and method for producing rubber product 住友橡胶工业株式会社 2018-02-16 CN disclosed
CN-102131980-B Electroconductive fibers with carbon nanotubes deposited thereon, electroconductive threads, fiber structure, and process for producing same UNIV HOKKAIDO NAT UNIV CORP 2013-12-25 CN disclosed
CN-102341533-B Method for preparing precursor fiber for preparing carbon fiber having high strength and high elastic modulus TOYO BOSEKI 2013-09-04 CN disclosed
CN-102770815-A Conductive multifilament yarn and conductive brush KURARAYLIVING CO LTD 2012-11-07 CN disclosed
CN-102341533-A Method for preparing precursor fiber for preparing carbon fiber having high strength and high elastic modulus TOYO BOSEKI 2012-02-01 CN disclosed
CN-102131980-A Electroconductive fibers with carbon nanotubes deposited thereon, electroconductive threads, fiber structure, and process for producing same UNIV HOKKAIDO NAT UNIV CORP 2011-07-20 CN disclosed