SCHEMBL9549486

SCHEMBL9549486

CCCCCCCCCCCCCCN(C)CCCCNC(=O)CCC

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.76
DNM1 Q05193 2/20 0.63
NAAA Q02083 1/20 0.61
FAAH O00519 3/20 0.53
EPHX1 P07099 4/20 0.50
KDM5A P29375 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
PHF8 Q9UPP1 1/20 0.50
EPHX2 P34913 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SLC6A5 Q9Y345 1/20 0.48

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
SCHEMBL25816685 0.95 CASP2 (0.66) CASP2DNM1NAAAFAAHKDM5A
SCHEMBL12792081 0.93 CASP2 (0.65) CASP2DNM1NAAAFAAHEPHX1
SCHEMBL9549308 0.93 DNM1 (0.73) CASP2DNM1NAAAFAAHKDM5A
SCHEMBL12903730 0.93 CASP2 (0.65) CASP2DNM1NAAAFAAHEPHX1
SCHEMBL31325297 0.93 DNM1 (0.73) CASP2DNM1NAAAFAAHKDM5A
SCHEMBL25816840 0.93 CASP2 (0.63) CASP2DNM1NAAAFAAHKDM5A
SCHEMBL30130591 0.92 DNM1 (0.76) CASP2DNM1NAAAFAAHKDM5A
SCHEMBL30130593 0.92 DNM1 (0.76) CASP2DNM1NAAAFAAHKDM5A
SCHEMBL24782018 0.90 DNM1 (0.69) CASP2DNM1NAAAFAAHKDM5A
SCHEMBL12792166 0.90 CASP2 (0.65) CASP2DNM1NAAAFAAHEPHX1

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