SCHEMBL926446

SCHEMBL926446

CCCCCCC(CC)C(N)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.54
CYP2D6 P10635 2/20 0.50
LMNA P02545 2/20 0.50
TP53 P04637 2/20 0.50
GMNN O75496 1/20 0.50
POLB P06746 1/20 0.50
THPO P40225 1/20 0.50
MTOR P42345 1/20 0.50
BLM P54132 1/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
CETP P11597 1/20 0.50
HTT P42858 1/20 0.50
UBE2N P61088 1/20 0.50
OPRM1 P35372 1/20 0.46
LAP3 P28838 2/20 0.45
GPR84 Q9NQS5 3/20 0.43
FFAR1 O14842 1/20 0.43

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
SCHEMBL8523720 0.91 SPHK1 (0.58) SPHK1CYP2D6LMNATP53GMNN
SCHEMBL9208410 0.91 SPHK1 (0.58) SPHK1CYP2D6LMNATP53GMNN
SCHEMBL10398801 0.91 SPHK1 (0.58) SPHK1CYP2D6LMNATP53GMNN
SCHEMBL8089181 0.91 SPHK1 (0.58) SPHK1CYP2D6LMNATP53GMNN
SCHEMBL21414 0.91 SPHK1 (0.58) SPHK1CYP2D6LMNATP53GMNN
SCHEMBL8061906 0.91 CA2 (0.41) SPHK1CYP2D6LMNATP53GMNN
Hydrochloric Acid SCHEMBL4622842 0.88 SPHK1 (0.56) SPHK1CYP2D6LMNATP53GMNN
Hydrochloric Acid SCHEMBL11508474 0.88 SPHK1 (0.56) SPHK1CYP2D6LMNATP53GMNN
Hydrochloric Acid SCHEMBL10706435 0.88 SPHK1 (0.56) SPHK1CYP2D6LMNATP53GMNN
SCHEMBL11137785 0.88 SPHK1 (0.54) SPHK1CYP2D6LMNATP53GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481652-B2 Thermoplastic polyamides having polyether amines BASF SE (DE) 2013-07-09 US disclosed
EP-2282634-A2 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ANGUS CHEMICAL COMPANY (US) 2011-02-16 EP disclosed
US-20110021686-A1 POLYAMIDE NANOCOMPOSITES WITH HYPER-BRANCHED POLYETHERAMINES BASF SE (DE) 2011-01-27 US disclosed
US-20110021687-A1 POLYAMIDE NANOCOMPOSITES WITH HYPER-BRANCHED POLYETHYLENEIMINES BASF SE (DE) 2011-01-27 US disclosed
US-20110009566-A1 THERMOPLASTIC POLYAMIDES HAVING POLYETHER AMINES BASF SE (DE) 2011-01-13 US disclosed
WO-2009140061-A2 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ANGUS CHEMICAL COMPANY (US) 2009-11-19 WO disclosed