SCHEMBL7943647

SCHEMBL7943647

CCCCCCCCCCCCCCC(CCCCCCCCCCC)OCCCN

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.59
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
EPHX1 P07099 1/20 0.48
TLR2 O60603 5/20 0.47
CYP3A4 P08684 1/20 0.43

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
SCHEMBL7943619 1.00 DNM1 (0.59) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1151950 1.00 DNM1 (0.59) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL7941081 1.00 DNM1 (0.59) DNM1MEN1KMT2AALDH1A1TSHR
Bromide SCHEMBL28653534 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL3232004 0.98 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4180677 0.96 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL23270387 0.92 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL3241476 0.92 DNM1 (0.60) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL2352070 0.90 DNM1 (0.62) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4117174 0.90 DNM1 (0.52) 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
US-6225394-B1 USEFUL FOR BARRIER LAYERS IN MULTI-PACKAGING AND FOR COATINGS AMCOL INTERNATIONAL CORPORATION 2001-05-01 US disclosed