SCHEMBL7917515

SCHEMBL7917515

O=C1NCC=NN1c1cc(Cl)c(Sc2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
NOTUM Q6P988 1/20 0.35
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
PTGIR P43119 2/20 0.33
TYMS P04818 2/20 0.32
TP53 P04637 3/20 0.32
MAPK1 P28482 1/20 0.31
PKM P14618 1/20 0.31
DHFR P00374 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPK14 Q16539 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL7990084 0.80
SCHEMBL7910217 0.78 GAA (0.43) GAALMNAMEN1KMT2ACYP3A4
SCHEMBL7910290 0.77 CHRM2 (0.36) NOTUM
SCHEMBL7838791 0.77 ALDH1A1 (0.35) GAALMNAMEN1KMT2APKM
SCHEMBL7919693 0.76 MEN1 (0.34) MEN1KMT2ACYP3A4
SCHEMBL7917049 0.76 MEN1 (0.34) MEN1KMT2A
SCHEMBL7919224 0.74 MEN1 (0.33) GAALMNAMEN1KMT2ACYP2C9
SCHEMBL7917711 0.74 MEN1 (0.31) GAALMNAMEN1KMT2ACYP2C9
SCHEMBL7838454 0.73 MEN1 (0.54) GAALMNAMEN1KMT2ACYP2C9
SCHEMBL7917032 0.72 ENPP2 (0.34) LMNAMEN1KMT2ACYP3A4PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6211178-B1 ANTIPROTOZOA AGENTS FOR COCCIDIOIDES; CYCLIZATION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-04-03 US disclosed
US-5994355-A ANTIPROTOZOA AGENTS, PARASITICIDE; VETERINARY MEDICINE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-30 US disclosed
EP-0648760-B1 Triazine derivative, production and use thereof TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-01-27 EP disclosed
EP-0648760-A2 Triazine derivative, production and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-04-19 EP disclosed