SCHEMBL17054697

SCHEMBL17054697

CN1C/C(=C\c2ccc(N(C)C)cc2)C(=O)/C(=C/c2ccc(N(C)C)cc2)C1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.66
NSD2 O96028 1/20 0.60
MAPT P10636 5/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
ACHE P22303 3/20 0.59
LMNA P02545 3/20 0.59
ALDH1A1 P00352 2/20 0.59
BCHE P06276 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.57
RAB9A P51151 3/20 0.57
NPC1 O15118 2/20 0.57
MAPK1 P28482 1/20 0.57
MCOLN3 Q8TDD5 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
HTT P42858 3/20 0.56
PTGS2 P35354 2/20 0.56
HPGD P15428 1/20 0.55
KDM4E B2RXH2 1/20 0.54
MAOB P27338 3/20 0.52

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
SCHEMBL8372688 1.00 CYP1A2 (0.66) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL17051290 0.88 CYP1A2 (0.52) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL8376224 0.83 DRD3 (0.59) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL2203150 0.83 ACHE (0.57) CYP1A2MAPTMEN1KMT2AACHE
SCHEMBL2203151 0.83 ACHE (0.57) CYP1A2MAPTMEN1KMT2AACHE
SCHEMBL8376284 0.83 CYP1A2 (0.60) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL2868624 0.82 CYP1A2 (0.86) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL11966165 0.82 CYP1A2 (0.86) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL2869244 0.82 CYP1A2 (0.86) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL29099913 0.82 CYP1A2 (0.86) CYP1A2NSD2MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663690-B2 UV-curable silicone release compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-05-30 US disclosed
US-20150247078-A1 UV-CURABLE SILICONE RELEASE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2015-09-03 US disclosed