SCHEMBL9137286

SCHEMBL9137286

CCCCCCOC(CC)CCCN

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.60
TLR2 O60603 6/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
EPHX1 P07099 1/20 0.44
CYP3A4 P08684 1/20 0.41

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
SCHEMBL23270387 0.92 DNM1 (0.55) DNM1TLR2MEN1KMT2AALDH1A1
SCHEMBL8953533 0.90 DNM1 (0.62) DNM1TLR2MEN1KMT2AALDH1A1
SCHEMBL7628426 0.90 DNM1 (0.62) DNM1TLR2MEN1KMT2AALDH1A1
SCHEMBL4117174 0.90 DNM1 (0.52) DNM1TLR2MEN1KMT2AALDH1A1
SCHEMBL30340413 0.88 CYP3A4 (0.52) DNM1TLR2MEN1KMT2AALDH1A1
SCHEMBL13292250 0.88 DNM1 (0.57) DNM1TLR2ALDH1A1
SCHEMBL7156427 0.88 DNM1 (0.57) DNM1TLR2ALDH1A1
SCHEMBL23017083 0.88 DNM1 (0.57) DNM1TLR2ALDH1A1
SCHEMBL28360383 0.88 DNM1 (0.57) DNM1TLR2ALDH1A1
SCHEMBL25258976 0.88 DNM1 (0.57) DNM1TLR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5468422-A Composition for use in washing and cleansing vulcanization molds SILVANI ANTINCEDI (IT) 1995-11-21 US claimed