SCHEMBL8080946

SCHEMBL8080946

Cc1c[nH]c(C(=O)OC(=O)c2nc(C)c[nH]2)n1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL28168679 0.86 KDM4E (0.44) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL2423817 0.82 KDM4E (0.47) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL5151745 0.80 NPC1 (0.32)
SCHEMBL2854030 0.80 NOTUM (0.32)
Bromide SCHEMBL7429002 0.78 NPC1 (0.32)
SCHEMBL148063 0.78
Bromide SCHEMBL27914400 0.77 SMN1; SMN2 (0.35) KMT2A
Water SCHEMBL29953274 0.77 NOTUM (0.39) KDM4EALDH1A1
SCHEMBL19603001 0.75
Zinc Ion SCHEMBL14482007 0.75

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6124246-A High temperature epoxy resin compositions, additives and methods HALLIBURTON ENERGY SERVICES, INC. (US) 2000-09-26 US disclosed