SCHEMBL8557706

SCHEMBL8557706

O=C1c2ccccc2C(=O)N1c1nc(N2C(=O)c3ccccc3C2=O)nc(N2C(=O)c3ccccc3C2=O)n1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALPL P05186 5/20 0.53
POLB P06746 1/20 0.50
HTT P42858 1/20 0.48
LMNA P02545 1/20 0.47
ALDH1A1 P00352 2/20 0.47
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
AR P10275 2/20 0.46
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
SCN2A Q99250 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
SCHEMBL8555373 0.89 ALPL (0.46) MEN1KMT2AALPLPOLBHTT
SCHEMBL8155472 0.89 MEN1 (0.55) MEN1KMT2AALPLPOLBHTT
SCHEMBL8733851 0.87 ALDH1A1 (0.50) MEN1KMT2AALPLPOLBHTT
SCHEMBL10637058 0.85 ALPL (0.50) MEN1KMT2AALPLPOLBHTT
SCHEMBL5322518 0.85 ALPL (0.44) MEN1KMT2AALPLPOLBHTT
SCHEMBL824432 0.82 ALDH1A1 (0.62) MEN1KMT2AHTTLMNAALDH1A1
SCHEMBL29714525 0.81 POLB (0.59) MEN1KMT2AALPLPOLBHTT
SCHEMBL28663483 0.81 POLB (0.59) MEN1KMT2AALPLPOLBHTT
SCHEMBL8163716 0.78 ALDH1A1 (0.50) MEN1KMT2AALPLPOLBHTT
SCHEMBL22566778 0.75 GRM5 (0.53) ALPLPOLBHSD17B10

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-0885214-A1 CYCLIC IMIDO-1,3,5-TRIAZINE CROSSLINKING AGENTS Cytec Technology Corp. (US) 1998-12-23 EP claimed
WO-1997031914-A1 CYCLIC IMIDO-1,3,5-TRIAZINE CROSSLINKING AGENTS CYTEC TECHNOLOGY CORP. (US) 1997-09-04 WO claimed
US-4555565-A Ring-chain polymer containing triaryl-s-triazine ring and other heat-resistant heterocyclic rings HSU LI CHEN 1985-11-26 US disclosed