SCHEMBL7910299

SCHEMBL7910299

O=C1NCCNN1c1cc(Cl)c(C(CO)c2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NSD2 O96028 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.32
DRD4 P21917 3/20 0.31
MEN1 O00255 1/20 0.31
NR1I2 O75469 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
SLC6A9 P48067 1/20 0.30
SCN8A Q9UQD0 1/20 0.30
CACNA2D1 P54289 3/20 0.30
CACNA1B Q00975 3/20 0.30
CACNB1 Q02641 3/20 0.30

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
SCHEMBL7910310 0.78 SCN8A (0.34) MAPTKDM4ELMNASMN1; SMN2SCN8A
SCHEMBL7922620 0.78 MEN1 (0.53) ALDH1A1MAPTLMNAGAAHPGD
SCHEMBL7919718 0.77 POLB (0.32) ALDH1A1MAPTKDM4ENSD2LMNA
SCHEMBL7917015 0.74 DRD4 (0.32) LMNAALKBH5DRD4MEN1NR1I2
SCHEMBL5566905 0.69 MEN1 (0.65) MEN1NR1I2KMT2A
SCHEMBL7919224 0.65 MEN1 (0.33) ALDH1A1MAPTKDM4ENSD2LMNA
SCHEMBL9823338 0.65 MDM2 (0.33) MAPTALKBH5MEN1NR1I2KMT2A
SCHEMBL5566928 0.65 MEN1 (0.59) MEN1NR1I2KMT2A
SCHEMBL7922537 0.65 MAPT (0.39) ALDH1A1MAPTKDM4ELMNAMEN1
SCHEMBL1979065 0.65 TSHR (0.44) LMNAHPGDMEN1KMT2A

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