SCHEMBL12831082

SCHEMBL12831082

O=C(Nc1ccccc1N1CCCCC1)c1ccc(-n2ncc3ccccc32)o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 7/20 0.62
▸ ALDH1A1 P00352 5/20 0.57
▸ GAA P10253 4/20 0.57
▸ MAPK10 P53779 3/20 0.57
▸ HTT P42858 2/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.57
▸ MAPT P10636 4/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ ATM Q13315 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ POLB P06746 1/20 0.53
▸ HPGD P15428 3/20 0.53
▸ LMNA P02545 1/20 0.53
▸ CHEK1 O14757 1/20 0.52
▸ ALOX15 P16050 1/20 0.51
▸ NTRK3 Q16288 1/20 0.48
▸ NTRK2 Q16620 1/20 0.48

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
SCHEMBL11923885 0.87 ALDH1A1 (0.48) CSF1RALDH1A1GAAMAPK10HTT
SCHEMBL11923886 0.87 ALDH1A1 (0.48) CSF1RALDH1A1GAAMAPK10HTT
SCHEMBL12830783 0.85 ALDH1A1 (0.54) CSF1RALDH1A1GAAMAPK10HTT
SCHEMBL11923865 0.81 CHEK1 (0.66) MAPTCHEK1PIM1PIM3
SCHEMBL11923888 0.79 PIM2 (0.57) PIM1PIM3
SCHEMBL11923884 0.79 PIM2 (0.57) PIM1PIM3
SCHEMBL16519597 0.77 CHEK1 (0.82) MAPTNPSR1LMNACHEK1NTRK3
SCHEMBL13148069 0.77 CSF1R (1.00) CSF1RALDH1A1GAAMAPK10HTT
SCHEMBL3081171 0.76 CSF1R (0.75) CSF1RALDH1A1GAAMAPK10HTT
SCHEMBL13147762 0.75 CSF1R (1.00) CSF1RALDH1A1GAAMAPK10HTT

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
WO-2011025706-A2 HETEROCYCLIC AMIDE COMPOUNDS AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2011-03-03 — — WO disclosed
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