SCHEMBL9549210

SCHEMBL9549210

CCCCCCCCCC(=O)NCCCN(CCCNC(=O)CCCCCCCCC)CCCNC(=O)CCCCCCCCC

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.77
FAAH O00519 5/20 0.68
NAAA Q02083 1/20 0.65
CASP2 P42575 1/20 0.63
EPHX2 P34913 3/20 0.55
SELP P16109 1/20 0.55
CNR1 P21554 2/20 0.54
ALDH1A1 P00352 2/20 0.54
HPGD P15428 2/20 0.54
TRPV1 Q8NER1 1/20 0.54
MEN1 O00255 1/20 0.54
MAPT P10636 1/20 0.54
ALOX12 P18054 1/20 0.54
BLM P54132 1/20 0.54
KMT2A Q03164 1/20 0.54
TDP1 Q9NUW8 1/20 0.54

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
SCHEMBL9549484 1.00 DNM1 (0.77) DNM1FAAHNAAACASP2EPHX2
SCHEMBL28138496 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL117059 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL117935 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL116819 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL12515852 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL8398740 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL116915 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL3288198 0.98 DNM1 (0.75) DNM1FAAHNAAACASP2EPHX2
SCHEMBL9549222 0.98 DNM1 (0.75) 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