Simazine

Simazine

SCHEMBL3356949

CCNc1nc(Cl)nc(NCC)n1.Nc1nc2cc(Cl)ccc2o1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.64
▸ MAPT P10636 3/20 0.64
▸ CYP1A2 P05177 1/20 0.64
▸ THRB P10828 1/20 0.64
▸ ALOX15 P16050 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ PIK3CG P48736 1/20 0.49
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ CASP3 P42574 3/20 0.43
▸ SENP7 Q9BQF6 3/20 0.43
▸ SENP6 Q9GZR1 3/20 0.43
▸ NFKB1 P19838 2/20 0.43
▸ NFKB2 Q00653 2/20 0.43
▸ RELA Q04206 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ SENP8 Q96LD8 2/20 0.43

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
Zoxazolamine SCHEMBL10891033 0.80 LMNA (1.00) LMNAMAPTCYP1A2THRBALOX15
Zoxazolamine SCHEMBL251567 0.80 LMNA (1.00) LMNAMAPTCYP1A2THRBALOX15
Zoxazolamine SCHEMBL29378757 0.80 LMNA (1.00) LMNAMAPTCYP1A2THRBALOX15
Zoxazolamine SCHEMBL10840280 0.72 LMNA (0.81) LMNAMAPTCYP1A2THRBALOX15
Simazine SCHEMBL37774 0.70 LMNA (1.00) LMNAMAPTCYP1A2KMT2AMEN1
Simazine SCHEMBL8409822 0.70 LMNA (1.00) LMNAMAPTCYP1A2KMT2AMEN1
Simazine SCHEMBL9130727 0.70 LMNA (1.00) LMNAMAPTCYP1A2KMT2AMEN1
SCHEMBL17267694 0.68 MAPT (0.74) LMNAMAPTCYP1A2THRBALOX15
SCHEMBL30386387 0.68 MAPT (0.74) LMNAMAPTCYP1A2THRBALOX15
Simazine SCHEMBL28076157 0.68 LMNA (0.95) LMNAMAPTCYP1A2KMT2AMEN1

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
US-20120128777-A1 COMPOSITIONS CONTAINING LIPID MICRO- OR NANOPARTICLES FOR THE ENHANCEMENT OF THE DERMAL ACTION OF SOLID PARTICLES PHARMASOL GMBH (DE) 2012-05-24 — — US claimed
EP-2218447-A1 Compositions containing lipid micro- or nanoparticles for the enhancement of the dermal action of solid particles PharmaSol GmbH (DE) 2010-08-18 — — EP claimed
WO-2010051918-A2 COMPOSITIONS CONTAINING LIPID MICRO- OR NANOPARTICLES FOR THE ENHANCEMENT OF THE DERMAL ACTION OF SOLID PARTICLES PHARMASOL GMBH (DE) 2010-05-14 — — WO claimed
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