SCHEMBL9640806

SCHEMBL9640806

CCCCCCCN(CC(C)O)CC(C)O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 4/20 0.42
▸ PLA2G1B P04054 1/20 0.41
▸ PLA2G2A P14555 1/20 0.41
▸ GGPS1 O95749 3/20 0.40
▸ SPHK1 Q9NYA1 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ MAPT P10636 1/20 0.37
▸ GBA1 P04062 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ THRB P10828 1/20 0.36

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
SCHEMBL561512 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL561444 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL438628 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL8686917 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL8686024 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL439340 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL562379 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL560922 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL561242 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1
SCHEMBL8686898 1.00 DNM1 (0.42) DNM1PLA2G1BPLA2G2AGGPS1SPHK1

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
US-5128408-A Quaternized amino polyurethane- or polyurethaneurea-polysiloxanes treated with heparin TOYO BOSEKI KABUSHIKI KAISHA (JP) 1992-07-07 — — US disclosed
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