SCHEMBL7046333

SCHEMBL7046333

COc1ccc(C2NC(=O)NC(=O)N2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 2/20 0.57
KDM4E B2RXH2 5/20 0.53
ALDH1A1 P00352 4/20 0.53
GAA P10253 4/20 0.53
MAPT P10636 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
TP53 P04637 2/20 0.53
PBRM1 Q86U86 1/20 0.50
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
HPGD P15428 3/20 0.46
CASP1 P29466 1/20 0.46
MPI P34949 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
MAOA P21397 1/20 0.44
PTGS2 P35354 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL7167696 0.78 ALDH1A1 (0.67) KDM4EALDH1A1GAAMAPTMEN1
SCHEMBL24028249 0.78 KDM4E (0.58) TNKS2KDM4EALDH1A1GAAMAPT
SCHEMBL24017074 0.76 ALDH1A1 (0.53) TNKS2KDM4EALDH1A1GAAMAPT
SCHEMBL24017073 0.76 ALDH1A1 (0.53) TNKS2KDM4EALDH1A1GAAMAPT
SCHEMBL21891264 0.74 MEN1 (0.74) TNKS2KDM4EALDH1A1GAAMAPT
SCHEMBL6827562 0.74 DDB1 (0.51) KDM4EALDH1A1GAAMAPTMEN1
SCHEMBL6385836 0.73 HPGD (0.53) KDM4EALDH1A1GAAMAPTKMT2A
SCHEMBL16108431 0.73 KDM4E (0.49) TNKS2KDM4EALDH1A1GAAMAPT
SCHEMBL29913510 0.73 TNKS2 (1.00) TNKS2KDM4EALDH1A1GAAMAPT
SCHEMBL7674927 0.73 TNKS2 (1.00) TNKS2KDM4EALDH1A1GAAMAPT

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-0937716-B1 Process for the preparation of phenyldichloro-1,3,5-triazines CIBA SC HOLDING AG (CH) 2003-04-09 EP disclosed
US-6057444-A REACTION OF ALDEHYDE WITH BIURET IN HYDROCHLORIC ACID WITH METHYLSULFONIC ACID, OXIDATION AND CHLORINATION CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-05-02 US disclosed
EP-0937716-A2 Process for the preparation of phenyldichloro-1,3,5-triazines Ciba SC Holding AG (CH) 1999-08-25 EP disclosed