SCHEMBL5452974

SCHEMBL5452974

OC1CCCCC1NC(=S)Nc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.57
MAPT P10636 6/20 0.57
GAA P10253 5/20 0.57
LMNA P02545 4/20 0.57
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
MAPK1 P28482 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
ALOX12 P18054 4/20 0.51
ALDH1A1 P00352 5/20 0.50
HTT P42858 2/20 0.50
CYP3A4 P08684 2/20 0.50
TAS2R38 P59533 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TP53 P04637 1/20 0.50
EPHX2 P34913 1/20 0.49
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
NOX1 Q9Y5S8 1/20 0.47
CYP1A2 P05177 1/20 0.46

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
SCHEMBL28033892 0.90 SMN1; SMN2 (0.64) SMN1; SMN2MAPTGAALMNAKMT2A
SCHEMBL14851122 0.83 SMN1; SMN2 (0.56) SMN1; SMN2MAPTGAALMNAKMT2A
SCHEMBL14855962 0.83 SMN1; SMN2 (0.56) SMN1; SMN2MAPTGAALMNAKMT2A
SCHEMBL5447885 0.80 SMN1; SMN2 (0.84) SMN1; SMN2MAPTGAALMNAKMT2A
2-(Phenylamino)Cyclohexanol SCHEMBL432136 0.79 ALDH1A1 (0.51) SMN1; SMN2MAPTGAALMNAKMT2A
2-(Phenylamino)Cyclohexanol SCHEMBL432132 0.79 ALDH1A1 (0.51) SMN1; SMN2MAPTGAALMNAKMT2A
2-(Phenylamino)Cyclohexanol SCHEMBL432135 0.79 ALDH1A1 (0.51) SMN1; SMN2MAPTGAALMNAKMT2A
2-(Phenylamino)Cyclohexanol SCHEMBL432133 0.79 ALDH1A1 (0.51) SMN1; SMN2MAPTGAALMNAKMT2A
2-(Phenylamino)Cyclohexanol SCHEMBL432131 0.79 ALDH1A1 (0.51) SMN1; SMN2MAPTGAALMNAKMT2A
SCHEMBL15250703 0.79 MAPT (0.52) SMN1; SMN2MAPTGAALMNAKMT2A

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