SCHEMBL7023599

SCHEMBL7023599

Nc1c(N)c(Cl)c(Cl)c(Cl)c1N

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP3A4 P08684 1/20 0.32
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL4705260 0.95 ALDH1A1 (0.33) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL29674828 0.95 ALDH1A1 (0.33) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL1807810 0.86 ALDH1A1 (0.33) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL21104563 0.82 CA1 (0.32) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL3341501 0.82 CA1 (0.32) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL6449656 0.82 CA1 (0.32) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL2204192 0.80 ALDH1A1 (0.35) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL38652792 0.78 CA1 (0.31) CA1CA2CA4ALDH1A1CYP3A4
SCHEMBL10691551 0.75
SCHEMBL8059878 0.72 CA1 (0.33) CA1CA2CA4ALDH1A1TSHR

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
EP-1275628-A1 Method for producing insensitive compressed explosive mixtures Diehl Munitionssysteme GmbH & Co. KG (DE) 2003-01-15 EP disclosed
EP-1275628-A1 Method for producing insensitive compressed explosive mixtures Diehl Munitionssysteme GmbH & Co. KG (DE) 2003-01-15 EP disclosed
US-20030005990-A1 Process for the production of a pressed insensitive explosive mixture DIEHL MUNITIONSSYSTEME GMBH & CO. KG (DE) 2003-01-09 US disclosed