SCHEMBL9549382

SCHEMBL9549382

CCCCCCCCCCCCN(C)CCCNC(=O)CCCCCCCCC

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.78
FAAH O00519 5/20 0.62
NAAA Q02083 1/20 0.61
CASP2 P42575 1/20 0.59
KDM5A P29375 2/20 0.54
KDM4C Q9H3R0 2/20 0.54
PHF8 Q9UPP1 1/20 0.54
EPHX2 P34913 3/20 0.53
SELP P16109 1/20 0.53
KDM5C P41229 1/20 0.51
KDM5B Q9UGL1 1/20 0.51
CNR1 P21554 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
TRPV1 Q8NER1 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
SCHEMBL9487043 1.00 DNM1 (0.78) DNM1FAAHNAAACASP2KDM5A
SCHEMBL30130591 0.98 DNM1 (0.76) DNM1FAAHNAAACASP2KDM5A
SCHEMBL30130593 0.98 DNM1 (0.76) DNM1FAAHNAAACASP2KDM5A
SCHEMBL25413209 0.98 DNM1 (0.81) DNM1FAAHNAAACASP2EPHX2
SCHEMBL3884774 0.98 DNM1 (0.81) DNM1FAAHNAAACASP2EPHX2
SCHEMBL25413301 0.98 DNM1 (0.81) DNM1FAAHNAAACASP2EPHX2
SCHEMBL9549506 0.98 DNM1 (0.81) DNM1FAAHNAAACASP2EPHX2
SCHEMBL9549308 0.97 DNM1 (0.73) DNM1FAAHNAAACASP2KDM5A
SCHEMBL31325297 0.97 DNM1 (0.73) DNM1FAAHNAAACASP2KDM5A
Bromide SCHEMBL11566193 0.92 DNM1 (0.71) DNM1FAAHNAAACASP2EPHX2

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