SCHEMBL9549308

SCHEMBL9549308

CCCCCCCCCCCCCCCCN(C)CCCCNC(=O)CCCCCCC

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.73
CASP2 P42575 1/20 0.65
FAAH O00519 5/20 0.62
NAAA Q02083 1/20 0.61
EPHX2 P34913 3/20 0.56
SLC6A5 Q9Y345 2/20 0.55
KDM5A P29375 2/20 0.54
KDM4C Q9H3R0 2/20 0.54
PHF8 Q9UPP1 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.52
KDM5C P41229 1/20 0.51
KDM5B Q9UGL1 1/20 0.51

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
SCHEMBL31325297 1.00 DNM1 (0.73) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL30130593 0.98 DNM1 (0.76) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL30130591 0.98 DNM1 (0.76) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL9549382 0.97 DNM1 (0.78) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL9487043 0.97 DNM1 (0.78) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL25413301 0.95 DNM1 (0.81) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL25413209 0.95 DNM1 (0.81) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL9549506 0.95 DNM1 (0.81) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL3884774 0.95 DNM1 (0.81) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL12903730 0.93 CASP2 (0.65) DNM1CASP2FAAHNAAAEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0288515-B1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS ISP INVESTMENTS INC. (US) 1993-05-05 EP disclosed
EP-0288515-A4 QUATERNIZED NITROGEN CONTAINING COMPOUNDS 1990-09-26 EP disclosed
US-4837013-A VISCOSITY ENHANCING AND HAIR CONDITIONING PROPERTIES GAF CORPORATION (US) 1989-06-06 US disclosed
EP-0288515-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS. GAF CORP (US) 1988-11-02 EP disclosed
WO-1988002985-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS GAF CORPORATION (US) 1988-05-05 WO disclosed