SCHEMBL7558901

SCHEMBL7558901

CN(N=NN=Nc1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.50
MEN1 O00255 8/20 0.50
RAB9A P51151 7/20 0.50
NPC1 O15118 6/20 0.50
MAPT P10636 5/20 0.50
MAPK1 P28482 4/20 0.50
TNNI3 P19429 1/20 0.50
TNNT2 P45379 1/20 0.50
TNNC1 P63316 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 5/20 0.48
ALDH1A1 P00352 4/20 0.48
TSHR P16473 2/20 0.48
HSD17B10 Q99714 1/20 0.48
CASP3 P42574 2/20 0.46
SENP8 Q96LD8 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
SENP6 Q9GZR1 2/20 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
SCHEMBL15151253 0.85 KMT2A (0.64) KMT2AMEN1RAB9ANPC1MAPT
Simtrazene SCHEMBL4971 0.78 MEN1 (0.48) KMT2AMEN1RAB9ANPC1MAPT
Simtrazene SCHEMBL6312204 0.78 MEN1 (0.48) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL12192668 0.75 MEN1 (0.41) KMT2AMEN1RAB9ANPC1MAPT
Azobenzene SCHEMBL18204482 0.72 ALDH1A1 (0.86) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL9684406 0.72 ALDH1A1 (0.46) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL13594601 0.72 MEN1 (0.44) KMT2AMEN1RAB9ANPC1MAPT
Azobenzene SCHEMBL18204483 0.72 ALDH1A1 (0.86) KMT2AMEN1RAB9ANPC1MAPT
Azobenzene SCHEMBL1405620 0.70 ALDH1A1 (0.75) KMT2AMEN1RAB9ANPC1MAPT
Azobenzene SCHEMBL1405621 0.70 ALDH1A1 (0.75) KMT2AMEN1RAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832157-B1 STABILIZER AND BLOWING AGENT USEFUL FOR RIGID FOAMED PVC CROMPTON CORP (US) 2002-07-17 EP disclosed
EP-0832157-A4 STABILIZER AND BLOWING AGENT USEFUL FOR RIGID FOAMED PVC CK WITCO CORP (US) 2000-01-26 EP disclosed
US-5821274-A ORGANOTIN COMPOUNDS WITCO CORPORATION (US) 1998-10-13 US disclosed
EP-0832157-A1 STABILIZER AND BLOWING AGENT USEFUL FOR RIGID FOAMED PVC WITCO CORPORATION (US) 1998-04-01 EP disclosed
US-5686025-A ORGANOTIN STABILIZERS WITCO CORPORATION (US) 1997-11-11 US disclosed
WO-1997025373-A1 STABILIZER AND BLOWING AGENT USEFUL FOR RIGID FOAMED PVC WITCO CORPORATION (US) 1997-07-17 WO disclosed