SCHEMBL14560451

SCHEMBL14560451

CN(C)CCc1c(C=O)n(C)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 8/20 0.47
▸ TDP1 Q9NUW8 5/20 0.46
▸ L3MBTL1 Q9Y468 4/20 0.46
▸ ATM Q13315 3/20 0.46
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HTR7 P34969 3/20 0.42
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ EGFR P00533 2/20 0.40
▸ SRC P12931 1/20 0.40
▸ HTR1A P08908 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ HTR1D P28221 1/20 0.39
▸ HTR1B P28222 1/20 0.39
▸ HTR1F P30939 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ GPR3 P46089 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
SCHEMBL14560449 0.81 EGFR (0.47) TDP1L3MBTL1ATMKDM4EMAPT
SCHEMBL14560453 0.79 ALDH1A1 (0.48) TDP1L3MBTL1ATMKDM4EALDH1A1
SCHEMBL14560448 0.78 EGFR (0.50) TDP1L3MBTL1ATMKDM4EALDH1A1
SCHEMBL14560443 0.78 EGFR (0.64) TDP1L3MBTL1ATMKDM4EALDH1A1
SCHEMBL14560446 0.77 RAD52 (0.49) TDP1L3MBTL1ATMKDM4EALDH1A1
SCHEMBL3804671 0.75 HTR6 (0.46) HTR6KDM4EMAPTHTR7ALDH1A1
SCHEMBL2758314 0.75 HTR6 (0.45) HTR6KDM4EMAPTHTR7ALDH1A1
SCHEMBL14560439 0.74 CNR1 (0.50) TDP1L3MBTL1ATMKDM4EHTR7
SCHEMBL1092376 0.71 L3MBTL1 (0.55) TDP1L3MBTL1ATMKDM4EMAPT
SCHEMBL14560411 0.70 ATM (0.43) TDP1L3MBTL1ATMKDM4EMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189721-B2 Bicyclic protein kinase inhibitors SUGEN INC. (US) 2007-03-13 — — US disclosed
US-7189721-B2 Bicyclic protein kinase inhibitors SUGEN INC. (US) 2007-03-13 — — US disclosed
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