SCHEMBL4448119

SCHEMBL4448119

CCCCCC(CC)C(OP(=O)(O)O)C(CC)CCCCC

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.59
PTPN1 P18031 1/20 0.47
FDPS P14324 6/20 0.47
LAP3 P28838 2/20 0.44
S1PR2 O95136 5/20 0.43
S1PR1 P21453 5/20 0.43
S1PR3 Q99500 5/20 0.43
S1PR4 O95977 4/20 0.43
LPAR3 Q9UBY5 3/20 0.41
LPAR1 Q92633 2/20 0.41
LPAR2 Q9HBW0 2/20 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
SCHEMBL29068425 0.94 SMPD1 (0.52) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL1995547 0.89 SMPD1 (0.56) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL4185332 0.87 SMPD1 (0.54) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL29068422 0.86 SMPD1 (0.46) SMPD1PTPN1FDPSLAP3LPAR3
SCHEMBL4448118 0.85 SMPD1 (0.44) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL9813006 0.82 SMPD1 (0.61) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL2150629 0.82 SMPD1 (0.61) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL2149510 0.82 SMPD1 (0.56) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL20260300 0.82 SMPD1 (0.61) SMPD1PTPN1FDPSLAP3S1PR2
SCHEMBL20381975 0.82 SMPD1 (0.61) SMPD1PTPN1FDPSLAP3S1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116745025-A membrane for water filtration 水通道蛋白有限公司 2023-09-12 CN disclosed
US-20090027586-A1 Thermoplastic Resin Composition, and Liquid Crystal Display Component Thereof or Information Recording Media Component Thereof POLYPLASTICS CO., LTD. (JP) 2009-01-29 US disclosed
EP-1992666-A1 THERMOPLASTIC RESIN COMPOSITION AND LIQUID CRYSTAL DISPLAY PART OR INFORMATION RECORDING MEDIUM PART USING THE COMPOSITION Polyplastics Co., Ltd. (JP) 2008-11-19 EP disclosed