SCHEMBL20169135

SCHEMBL20169135

CCCCOP(=O)(O)OCCCOP(=O)(O)OCCCOP(=O)(O)OCCCCCCN

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 7/20 0.55
LPAR2 Q9HBW0 6/20 0.55
LPAR1 Q92633 3/20 0.55
PLA2G2C Q5R387 1/20 0.48
CYP3A4 P08684 1/20 0.47
P2RY10 O00398 5/20 0.46
GABBR2 O75899 1/20 0.46
GABRR1 P24046 1/20 0.46
GABBR1 Q9UBS5 1/20 0.46
GPR34 Q9UPC5 2/20 0.45
DNM1 Q05193 2/20 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
Dodecylamine SCHEMBL28985670 0.96 LPAR3 (0.60) LPAR3LPAR2LPAR1PLA2G2CCYP3A4
Hexadecylamine SCHEMBL28985683 0.96 LPAR3 (0.60) LPAR3LPAR2LPAR1PLA2G2CCYP3A4
Dodecylamine SCHEMBL27830349 0.96 LPAR3 (0.60) LPAR3LPAR2LPAR1PLA2G2CCYP3A4
SCHEMBL9301085 0.94 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CDNM1
SCHEMBL10885700 0.94 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CDNM1
Dodecylamine SCHEMBL9495208 0.94 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CDNM1
Dodecylamine SCHEMBL10887166 0.94 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CDNM1
SCHEMBL22221628 0.94 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CDNM1
SCHEMBL9499065 0.94 LPAR3 (0.57) LPAR3LPAR2LPAR1PLA2G2CCYP3A4
Dodecylamine SCHEMBL17472938 0.94 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CDNM1

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
US-9976147-B2 STAT3 inhibitors and uses thereof CITY OF HOPE (US) 2018-05-22 US disclosed
US-9976147-B2 STAT3 inhibitors and uses thereof CITY OF HOPE (US) 2018-05-22 US disclosed