SCHEMBL21090668

SCHEMBL21090668

CCCCCCCCCCCCCCCCCCN(CCCC)CCCN(CCCC)CCCN

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 11/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
ALDH1A1 P00352 1/20 0.55
TSHR P16473 1/20 0.55
EPHX1 P07099 1/20 0.55
CHRM2 P08172 1/20 0.42
KDM5A P29375 2/20 0.41
PHF8 Q9UPP1 2/20 0.41
KDM4C Q9H3R0 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
SCHEMBL25844944 1.00 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL25844886 1.00 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL21090070 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL21091016 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL16186286 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL23127778 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL5981365 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL20957449 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL5703951 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL25844946 0.98 DNM1 (0.50) DNM1MEN1KMT2AALDH1A1TSHR

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
WO-2019112744-A1 COMPOSITIONS AND METHODS FOR REMOVING LIPSTICK USING BRANCHED POLYAMINES ECOLAB USA INC. (US) 2019-06-13 WO disclosed