SCHEMBL3797975

SCHEMBL3797975

CCCCCCC(OCCCC)C(OCCCC)(OCCCC)OP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 6/20 0.47
LPAR3 Q9UBY5 5/20 0.40
LPAR1 Q92633 4/20 0.40
FDPS P14324 5/20 0.40
LPAR2 Q9HBW0 2/20 0.40
LAP3 P28838 1/20 0.38
PTPN1 P18031 1/20 0.37

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
SCHEMBL3797974 0.88 SMPD1 (0.39) SMPD1LPAR3LPAR1FDPSLPAR2
SCHEMBL942147 0.87 SMPD1 (0.39) SMPD1LPAR3LPAR1FDPSLPAR2
SCHEMBL9462896 0.77 SMPD1 (0.42) SMPD1LPAR3LPAR1FDPSLPAR2
Phosphoric Acid SCHEMBL5931784 0.75 SMPD1 (0.44) SMPD1LPAR3LPAR1FDPSLPAR2
Pyrophosphoric Acid SCHEMBL2535717 0.74 SMPD1 (0.44) SMPD1LPAR3LPAR1FDPSLPAR2
Pyrophosphoric Acid SCHEMBL590095 0.74 SMPD1 (0.44) SMPD1LPAR3LPAR1FDPSLPAR2
Pyrophosphoric Acid SCHEMBL17025978 0.74 SMPD1 (0.44) SMPD1LPAR3LPAR1FDPSLPAR2
Pyrophosphoric Acid SCHEMBL27599648 0.74 SMPD1 (0.44) SMPD1LPAR3LPAR1FDPSLPAR2
SCHEMBL9858375 0.74 DNM1 (0.37) SMPD1
SCHEMBL28566312 0.74 DNM1 (0.37) SMPD1

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
US-8283277-B2 Photoactive TiO2 in coating materials BASF SE (DE) 2012-10-09 US disclosed
US-20100311572-A1 PHOTOACTIVE TIO2 IN COATING MATERIALS BASF SE (DE) 2010-12-09 US disclosed
US-20020061940-A1 Water-based, pigmented coating compositions BASF AKTIENGESELLSCHAFT (DE) 2002-05-23 US disclosed