SCHEMBL2913781

SCHEMBL2913781

CCOc1cc2nc(CC)c(C(=O)O)c(Nc3cccc(Cl)c3F)c2cc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.47
SCN5A Q14524 3/20 0.47
EGFR P00533 6/20 0.42
CSF1R P07333 4/20 0.40
PGK1 P00558 1/20 0.38
TLR9 Q9NR96 4/20 0.38
TLR7 Q9NYK1 2/20 0.38
CCNK O75909 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CCND3 P30281 1/20 0.37
CDK9 P50750 1/20 0.37
CDK6 Q00534 1/20 0.37

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
SCHEMBL2912772 0.87 MAPT (0.46) KCNH2SCN5AEGFRCSF1R
SCHEMBL2913777 0.82 KCNH2 (0.58) KCNH2SCN5AEGFRCSF1R
SCHEMBL2913426 0.81 CSF1R (0.51) KCNH2SCN5ACSF1RTLR9TLR7
SCHEMBL27744484 0.80 KCNH2 (0.49) KCNH2SCN5AEGFRCSF1R
SCHEMBL2911555 0.78 KCNH2 (0.53) KCNH2SCN5ACSF1R
SCHEMBL2911700 0.76 KCNH2 (0.51) KCNH2SCN5AEGFRCSF1R
SCHEMBL2910054 0.76 KCNH2 (0.74) KCNH2SCN5ACSF1R
SCHEMBL2911203 0.75 CSF1R (0.56) KCNH2SCN5AEGFRCSF1R
SCHEMBL2904048 0.75 KCNH2 (0.68) KCNH2SCN5ACSF1R
SCHEMBL2914186 0.74 KCNH2 (0.57) KCNH2SCN5ACSF1R

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-2010496-B1 4-ANILINOQUINOLINE-3-CARBOXAMIDES AS CSF-1R KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-08-25 EP disclosed