SCHEMBL7919178

SCHEMBL7919178

CC1=NN(c2cc(Cl)c(C(C#N)c3ccc(Cl)cc3)c(Cl)c2)C(=O)NC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
NR1I2 O75469 1/20 0.52
ALDH1A1 P00352 5/20 0.38
MAPT P10636 5/20 0.38
LMNA P02545 4/20 0.38
HTT P42858 4/20 0.38
TDP1 Q9NUW8 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.34
POLB P06746 2/20 0.34
FPR2 P25090 1/20 0.34
PROKR1 Q8TCW9 1/20 0.34
GAA P10253 4/20 0.34
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.32
MAPK1 P28482 2/20 0.32
BLM P54132 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
SLC22A1 O15245 1/20 0.32
EGFR P00533 1/20 0.32

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
SCHEMBL7838454 0.80 MEN1 (0.54) KMT2AMEN1NR1I2ALDH1A1MAPT
SCHEMBL7919347 0.78 MEN1 (0.47) KMT2AMEN1NR1I2ALDH1A1MAPT
SCHEMBL7910217 0.74 GAA (0.43) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL7922620 0.72 MEN1 (0.53) KMT2AMEN1NR1I2ALDH1A1MAPT
SCHEMBL7922508 0.71 MEN1 (0.52) KMT2AMEN1NR1I2ALDH1A1MAPT
SCHEMBL9823375 0.71 MEN1 (0.49) KMT2AMEN1NR1I2ALDH1A1MAPT
SCHEMBL7919364 0.70 MEN1 (0.46) KMT2AMEN1NR1I2ALDH1A1MAPT
SCHEMBL7910256 0.69 MEN1 (0.44) KMT2AMEN1NR1I2ALDH1A1MAPT
SCHEMBL14395446 0.68 MEN1 (0.66) KMT2AMEN1NR1I2ALDH1A1MAPT
Diclazuril SCHEMBL126138 0.68 MEN1 (1.00) KMT2AMEN1NR1I2L3MBTL1THRB

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