SCHEMBL3944189

SCHEMBL3944189

CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(F)c(C(=O)Nc3cccnc3)c2)c1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.79
▸ BRAF P15056 7/20 0.64
▸ MAPT P10636 2/20 0.59
▸ ALDH1A1 P00352 2/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ LMNA P02545 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ CSF1R P07333 6/20 0.56
▸ HTT P42858 1/20 0.55
▸ RAB9A P51151 1/20 0.54

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
SCHEMBL3941970 0.89 L3MBTL1 (0.79) L3MBTL1BRAFMAPTALDH1A1MEN1
SCHEMBL3931681 0.84 BRAF (0.79) BRAFCSF1R
SCHEMBL3935559 0.83 BRAF (0.80) BRAFCSF1R
SCHEMBL3931363 0.82 CSF1R (0.80) BRAFCSF1R
SCHEMBL3936478 0.81 CSF1R (0.81) L3MBTL1BRAFMEN1KMT2ACSF1R
SCHEMBL3937125 0.81 CSF1R (0.79) BRAFMAPTMEN1KMT2ACSF1R
SCHEMBL4020844 0.81 CSF1R (0.64) BRAFCSF1R
SCHEMBL3941905 0.81 CSF1R (0.77) BRAFMEN1KMT2ACSF1R
SCHEMBL3932800 0.80 BRAF (0.75) L3MBTL1BRAFMAPTCSF1R
SCHEMBL3944890 0.80 CSF1R (0.78) BRAFALDH1A1KMT2ASMN1; SMN2CSF1R

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
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