SCHEMBL28296364

SCHEMBL28296364

CCCCCCCCCCCCCCCC(NCCCCCCCCCCCC)P(=O)(O)OCCN

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G2D Q9UNK4 1/20 0.41
LAP3 P28838 2/20 0.41
S1PR2 O95136 3/20 0.40
S1PR1 P21453 3/20 0.40
S1PR3 Q99500 3/20 0.40
S1PR5 Q9H228 1/20 0.40
PLA2G2C Q5R387 1/20 0.40
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
SMPD1 P17405 3/20 0.40
ANPEP P15144 1/20 0.39
ERAP2 Q6P179 1/20 0.39
FDPS P14324 4/20 0.39
LPAR3 Q9UBY5 3/20 0.39
LPAR1 Q92633 2/20 0.39
LPAR2 Q9HBW0 2/20 0.39
RRM1 P23921 1/20 0.38
S1PR4 O95977 1/20 0.38

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
SCHEMBL28963400 0.72 PLA2G2D (0.43) PLA2G2DLAP3S1PR2S1PR1S1PR3
SCHEMBL27993049 0.71 LAP3 (0.43) PLA2G2DLAP3S1PR2S1PR1S1PR3
SCHEMBL28264154 0.71 LAP3 (0.50) PLA2G2DLAP3S1PR2S1PR1S1PR3
SCHEMBL7554036 0.70 PLA2G2C (0.51) PLA2G2DLAP3S1PR2S1PR1S1PR3
SCHEMBL23698927 0.69 CYP3A4 (0.40) PLA2G2DLAP3PLA2G2CGNAI3GNAO1
SCHEMBL7804496 0.69 LPAR3 (0.53) LAP3S1PR2S1PR1S1PR3SMPD1
SCHEMBL3147812 0.69 LPAR3 (0.62) PLA2G2DPLA2G2CSMPD1FDPSLPAR3
Dodecylamine SCHEMBL27738823 0.69 LPAR3 (0.68) LPAR3LPAR1LPAR2
SCHEMBL11155801 0.69 LPAR3 (0.62) PLA2G2DPLA2G2CSMPD1FDPSLPAR3
SCHEMBL2723071 0.69 LPAR3 (0.62) PLA2G2DPLA2G2CSMPD1FDPSLPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109913455-A A kind of siRNA for capableing for the treatment of cancer 宜春莲泽生物科技发展有限公司 2019-06-21 CN disclosed
CN-106467915-B SiRNA and its application and the method for inhibiting plk1 gene expression 苏州瑞博生物技术有限公司 2019-06-04 CN disclosed