SCHEMBL15548441

SCHEMBL15548441

CCC(C(=O)c1ccc(N2CCOCC2)cc1)N(C)C.O=C(Cc1ccccc1)c1ccc(N2CCOCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
GSK3B P49841 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
RORC P51449 4/20 0.42
MAOB P27338 1/20 0.41
HIF1A Q16665 1/20 0.41
ESR1 P03372 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
AOC3 Q16853 1/20 0.40

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
SCHEMBL966444 0.88 GSK3B (0.51) SMN1; SMN2GSK3BMEN1KMT2AMAPT
Ammonia Solution, Strong SCHEMBL27877917 0.86 GSK3B (0.50) SMN1; SMN2GSK3BMEN1KMT2AMAPT
SCHEMBL4620050 0.84 MAPT (0.44) SMN1; SMN2GSK3BMEN1KMT2AMAPT
SCHEMBL13005154 0.84 MAPT (0.61) SMN1; SMN2GSK3BMEN1KMT2AMAPT
SCHEMBL50144 0.84 SMN1; SMN2 (0.64) SMN1; SMN2GSK3BMEN1KMT2AMAPT
SCHEMBL755565 0.81 MAPT (0.48) SMN1; SMN2GSK3BMEN1KMT2AMAPT
SCHEMBL537643 0.80 ALDH1A1 (0.49) SMN1; SMN2GSK3BMEN1KMT2AMAPT
SCHEMBL2321900 0.79 SMN1; SMN2 (0.60) SMN1; SMN2GSK3BMEN1KMT2AMAPT
SCHEMBL23581994 0.78 GSK3B (0.49) SMN1; SMN2GSK3BMAPTALDH1A1HIF1A
SCHEMBL6049456 0.78 MAPT (0.46) SMN1; SMN2GSK3BMEN1KMT2AMAPT

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
EP-2875082-A1 FAST-DRYING, RADIATION-CURABLE COATING COMPOUNDS BASF SE (DE) 2015-05-27 EP disclosed
WO-2014012852-A1 FAST-DRYING, RADIATION-CURABLE COATING COMPOUNDS BASF SE (DE) 2014-01-23 WO disclosed