SCHEMBL28313169

SCHEMBL28313169

CN1CCN(c2ccc(-c3cccc4c3C(=O)NC4=O)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCB P05771 1/20 0.43
PRKCA P17252 1/20 0.43
PRKCH P24723 1/20 0.43
PRKCE Q02156 1/20 0.43
PRKCQ Q04759 1/20 0.43
PRKCD Q05655 1/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 2/20 0.43
EGFR P00533 1/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MAP4K1 Q92918 2/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
ADRA2C P18825 1/20 0.41
GFER P55789 1/20 0.41
PTK2B Q14289 1/20 0.41

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
SCHEMBL30775205 0.77 KDR (0.49) PRKCDMELKPARP1
SCHEMBL27453645 0.74 ALDH1A1 (0.46) KMT2AEGFRALDH1A1KDM4EGAA
SCHEMBL31187523 0.73 MAPT (0.54) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL135332 0.71 GSK3B (0.56) MAPTKMT2ALMNAALDH1A1KDM4E
SCHEMBL14463468 0.71 PRKCB (0.53) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL9116090 0.71 GSK3B (0.45) MAPTKMT2AALDH1A1KDM4EGAA
SCHEMBL2894929 0.71 ALDH1A1 (0.46) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL30956736 0.71 CASP3 (0.48) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL29032840 0.70 GSK3B (0.54) MAPTKMT2ALMNAALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL28821133 0.70 GSK3B (0.54) MAPTKMT2ALMNAALDH1A1KDM4E

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
CN-110028439-A Phthalimide analog derivative and its preparation method and application 四川大学 2019-07-19 CN disclosed