SCHEMBL11083141

SCHEMBL11083141

CCCCCCCCCCCC(N)(N)CCCCCCCCC(N)N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
SPHK1 Q9NYA1 2/20 0.42
DNM1 Q05193 2/20 0.41
CYP2D6 P10635 2/20 0.39
SMPD1 P17405 2/20 0.39
LMNA P02545 2/20 0.39
FDPS P14324 2/20 0.39
TP53 P04637 2/20 0.39
LAP3 P28838 2/20 0.39
PLA2G1B P04054 1/20 0.39
PLA2G2A P14555 1/20 0.39
GMNN O75496 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL10952095 0.96 SMPD1 (0.44) OPRM1SPHK1DNM1CYP2D6SMPD1
SCHEMBL20603566 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL20603562 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL600646 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL20603561 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL20603558 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL20603553 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL22443839 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL20603560 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA
SCHEMBL20603567 0.83 OPRM1 (0.60) OPRM1SPHK1DNM1CYP2D6LMNA

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
EP-0101177-A1 A process and catalyst composition for upgrading a hydrocarbon feedstock MOBIL OIL CORPORATION (US) 1984-02-22 EP disclosed