SCHEMBL4953708

SCHEMBL4953708

CCCCCCCCCCCCCC(N)C(C)CCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.54
SPHK1 Q9NYA1 2/20 0.50
CYP2D6 P10635 2/20 0.47
TP53 P04637 2/20 0.47
LMNA P02545 2/20 0.47
GMNN O75496 1/20 0.47
POLB P06746 1/20 0.47
THPO P40225 1/20 0.47
MTOR P42345 1/20 0.47
BLM P54132 1/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 1/20 0.47
CETP P11597 1/20 0.47
HTT P42858 1/20 0.47
UBE2N P61088 1/20 0.47
DNM1 Q05193 2/20 0.44
S1PR2 O95136 5/20 0.42
S1PR1 P21453 5/20 0.42

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
SCHEMBL19577535 1.00 OPRM1 (0.54) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL4953066 1.00 OPRM1 (0.54) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL4953074 1.00 OPRM1 (0.54) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL30989582 0.98 OPRM1 (0.56) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL15435975 0.98 OPRM1 (0.56) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL10398186 0.98 OPRM1 (0.56) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL9656673 0.98 OPRM1 (0.56) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL28515707 0.98 OPRM1 (0.56) OPRM1SPHK1CYP2D6TP53LMNA
SCHEMBL28620894 0.98 OPRM1 (0.56) OPRM1SPHK1CYP2D6TP53LMNA
Bromide SCHEMBL27808697 0.95 OPRM1 (0.54) OPRM1SPHK1CYP2D6TP53LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005042675-A2 METHODS FOR INHIBITING HYDRATE BLOCKAGE IN OIL AND GAS PIPELINES USING SIMPLE QUATERNARY AMMONIUM AND PHOSPHONIUM COMPOUNDS CHAMPION TECHNOLOGIES, INC. (US) 2005-05-12 WO claimed
US-20050085676-A1 Methods for inhibiting hydrate blockage in oil and gas pipelines using betaines and amine oxides CHAMPION TECHNOLOGIES, INC. 2005-04-21 US claimed
US-7381689-B2 Methods for inhibiting hydrate blockage in oil and gas pipelines using amide compounds CHAMPION TECHNOLOGIES, INC. (US) 2008-06-03 US disclosed
US-7264653-B2 Methods for inhibiting hydrate blockage in oil and gas pipelines using simple quaternary ammonium and phosphonium compounds CHAMPION TECHNOLOGIES, INC. (US) 2007-09-04 US disclosed
WO-2005042675-A2 METHODS FOR INHIBITING HYDRATE BLOCKAGE IN OIL AND GAS PIPELINES USING SIMPLE QUATERNARY AMMONIUM AND PHOSPHONIUM COMPOUNDS CHAMPION TECHNOLOGIES, INC. (US) 2005-05-12 WO disclosed
US-20050085676-A1 Methods for inhibiting hydrate blockage in oil and gas pipelines using betaines and amine oxides CHAMPION TECHNOLOGIES, INC. 2005-04-21 US disclosed
US-20050085675-A1 Methods for inhibiting hydrate blockage in oil and gas pipelines using ester compounds CHAMPION TECHNOLOGIES, INC. 2005-04-21 US disclosed
US-20050081714-A1 Methods for inhibiting hydrate blockage in oil and gas pipelines using simple quaternary ammonium and phosphonium compounds HARBISON-FISCHER, INC. 2005-04-21 US disclosed
US-20050085396-A1 Methods for inhibiting hydrate blockage in oil and gas pipelines using amino alcohols and ester compounds CHAMPION TECHNOLOGIES, INC. 2005-04-21 US disclosed
US-20050081432-A1 Methods for inhibiting hydrate blockage in oil and gas pipelines using amide compounds CLARIANT INTERNATIONAL LTD. (CH) 2005-04-21 US disclosed