SCHEMBL7922599

SCHEMBL7922599

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
HTT P42858 4/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 2/20 0.38
POLB P06746 2/20 0.38
CASP6 P55212 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 1/20 0.37
GAA P10253 1/20 0.36
GALR3 O60755 1/20 0.36
CYP3A4 P08684 1/20 0.36
NR2F2 P24468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7910217 0.79 GAA (0.43) MAPTHTTKMT2AMEN1TDP1
SCHEMBL7919391 0.76 NPSR1 (0.38) MAPTHTTKMT2AMEN1ALDH1A1
SCHEMBL7919178 0.75 KMT2A (0.52) MAPTHTTKMT2AMEN1TDP1
SCHEMBL7264321 0.73 CES2 (0.53) MAPTHTTLMNAALDH1A1L3MBTL1
SCHEMBL7910016 0.66 SRD5A2 (0.43) MAPTHTTKMT2AMEN1TDP1
SCHEMBL5566665 0.66 MEN1 (0.58) KMT2AMEN1
SCHEMBL7264062 0.66 HPGD (0.49) MAPTHTTKMT2AMEN1LMNA
SCHEMBL4746218 0.65 MAPK1 (0.63) MAPTHTTKMT2AMEN1LMNA
SCHEMBL7917755 0.64 MEN1 (0.53) KMT2AMEN1
SCHEMBL3179849 0.64 ALDH1A1 (0.46) MAPTHTTKMT2AMEN1LMNA

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