SCHEMBL29115207

SCHEMBL29115207

CC(C)CCCCCCCOP(O)O.CCCCCCCCCCCCCOP(OCCCCCCCCCCCCC)OCCCCCCCCCCCCC

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.35
LMNA P02545 1/20 0.34
DNM1 Q05193 2/20 0.33
SMPD1 P17405 3/20 0.33
USP2 O75604 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
THRB P10828 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
OPRM1 P35372 1/20 0.32
ZDHHC7 Q9NXF8 1/20 0.32
LPAR1 Q92633 2/20 0.32
LPAR3 Q9UBY5 2/20 0.32
LPAR2 Q9HBW0 1/20 0.32

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
SCHEMBL11049895 0.91 DNM1 (0.39) SPHK1LMNADNM1SMPD1THRB
SCHEMBL4539793 0.91 DNM1 (0.39) SPHK1LMNADNM1SMPD1THRB
SCHEMBL30659942 0.91 DNM1 (0.39) SPHK1LMNADNM1SMPD1THRB
SCHEMBL9621588 0.91 DNM1 (0.39) SPHK1LMNADNM1SMPD1THRB
SCHEMBL27888041 0.91 DNM1 (0.39) SPHK1LMNADNM1SMPD1THRB
SCHEMBL31300195 0.91 DNM1 (0.39) SPHK1LMNADNM1SMPD1THRB
SCHEMBL31124531 0.91 DNM1 (0.39) SPHK1LMNADNM1SMPD1THRB
SCHEMBL3565230 0.87 LMNA (0.39) LMNA
SCHEMBL9156581 0.87 LMNA (0.39) LMNA
SCHEMBL2043575 0.87 LMNA (0.39) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117120548-A Polycarbonate resin composition and molded article 出光兴产株式会社 2023-11-24 CN disclosed