SCHEMBL3942407

SCHEMBL3942407

Cc1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCC3)c2)cc1C(=O)Nc1cccnc1

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.77
KMT2A Q03164 2/20 0.77
ALDH1A1 P00352 2/20 0.77
LMNA P02545 1/20 0.75
BRAF P15056 11/20 0.75
POLB P06746 1/20 0.75
MAPT P10636 1/20 0.75
RECQL P46063 1/20 0.75
CTDSP1 Q9GZU7 1/20 0.75
TDP1 Q9NUW8 1/20 0.75
CSF1R P07333 1/20 0.64

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
SCHEMBL3932223 0.92 BRAF (0.71) MEN1KMT2AALDH1A1LMNABRAF
SCHEMBL3940456 0.88 BRAF (0.63) MEN1KMT2AALDH1A1LMNABRAF
SCHEMBL1649391 0.87 MEN1 (1.00) MEN1KMT2AALDH1A1LMNAPOLB
SCHEMBL3933255 0.86 BRAF (1.00) BRAFMAPTCSF1R
SCHEMBL3933045 0.85 BRAF (1.00) BRAFMAPTCSF1R
SCHEMBL3933251 0.84 BRAF (0.64) MEN1KMT2AALDH1A1LMNABRAF
SCHEMBL3944742 0.82 BRAF (0.75) BRAFMAPTCSF1R
SCHEMBL3937779 0.80 BRAF (1.00) BRAFCSF1R
SCHEMBL3932800 0.80 BRAF (0.75) BRAFMAPTCSF1R
SCHEMBL3934972 0.80 BRAF (0.78) BRAFMAPTCSF1R

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
EP-1831198-B1 PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-04-08 EP disclosed