SCHEMBL5456726

SCHEMBL5456726

COc1ccc(NC(=S)NC2CCCCC2)c(Cl)c1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.70
MAPT P10636 3/20 0.70
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
NPC1 O15118 2/20 0.70
CYP1A2 P05177 1/20 0.70
MAPK1 P28482 1/20 0.70
CYP2C19 P33261 1/20 0.70
ALDH1A1 P00352 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.60
TDP1 Q9NUW8 1/20 0.60
LMNA P02545 2/20 0.57
HTT P42858 2/20 0.55
POLB P06746 1/20 0.55
ALOX12 P18054 1/20 0.53
RAB9A P51151 1/20 0.53
GAA P10253 1/20 0.53

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
SCHEMBL19957270 0.93 ALDH1A1 (0.63) NPSR1MAPTMEN1KMT2ANPC1
SCHEMBL19957272 0.80 MAPT (0.55) NPSR1MAPTMEN1KMT2ANPC1
SCHEMBL28652654 0.78 SMN1; SMN2 (0.78) NPSR1MAPTMEN1KMT2ANPC1
SCHEMBL11542802 0.78 ALDH1A1 (0.57) NPSR1MAPTMEN1KMT2AALDH1A1
SCHEMBL20671206 0.77 HTT (0.64) MAPTMEN1KMT2ANPC1ALDH1A1
SCHEMBL19957213 0.77 FGFR4 (0.60) ALDH1A1HTT
SCHEMBL20927367 0.74 MEN1 (0.65) NPSR1MAPTMEN1KMT2ANPC1
SCHEMBL5413930 0.74 NPC1 (0.54) NPSR1MAPTMEN1KMT2ANPC1
SCHEMBL4353366 0.73 ALDH1A1 (0.76) NPSR1MAPTMEN1KMT2ANPC1
SCHEMBL21230467 0.71 TAS1R3 (0.71) MAPTMEN1KMT2ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101129295-B There is the binary initiator system of good storage stability and especially suitable for acidic system HERAEUS KULZER GMBH (DE) 2016-02-10 CN disclosed
CN-101129295-A 2-component initiator system (amine free) with storage stability and especially suitable for acidic systems HERAEUS KULZER GMBH (DE) 2008-02-27 CN disclosed
US-20070040151-A1 Two-component initiator system (amine-free) with very good storage stability and particular suitability for acid systems HERAEUS KULZER GMBH (DE) 2007-02-22 US disclosed