Methane

Methane

SCHEMBL27601733

C.CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1cnc(S)nc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 2/20 0.46
TP53 P04637 2/20 0.46
MDM2 Q00987 1/20 0.46
NAMPT P43490 1/20 0.44
HDAC1 Q13547 5/20 0.44
METAP1 P53582 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
AHR P35869 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
F10 P00742 1/20 0.40
P4HTM Q9NXG6 1/20 0.40
BRD9 Q9H8M2 1/20 0.40
TOP1 P11387 1/20 0.39

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
SCHEMBL5224578 0.84 KDM4E (0.44) MDM4TP53MDM2NAMPTHDAC1
SCHEMBL5229928 0.82 NAMPT (0.43) MDM4TP53MDM2NAMPTHDAC1
SCHEMBL5228223 0.82 MDM4 (0.62) MDM4TP53MDM2NAMPTHDAC1
SCHEMBL14885229 0.81 MEN1 (0.57) MDM4TP53MDM2NAMPTHDAC1
SCHEMBL5225778 0.81 MEN1 (0.47) MDM4TP53MDM2NAMPTHDAC1
SCHEMBL2829176 0.81 POLB (0.56) MDM4TP53NAMPTHDAC1MEN1
SCHEMBL22874499 0.80 P4HTM (0.65) MEN1KMT2AAHRP4HTM
SCHEMBL24890664 0.79 HDAC1 (0.53) MDM4TP53MDM2NAMPTHDAC1
SCHEMBL22874503 0.79 MEN1 (0.57) MDM4TP53MDM2NAMPTHDAC1
SCHEMBL2385003 0.79 MEN1 (0.48) MDM4TP53MDM2NAMPTHDAC1

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
CN-1662236-A Inhibitors of histone deacetylase ASTRAZENECA AB (SE) 2005-08-31 CN disclosed