SCHEMBL28297895

SCHEMBL28297895

Cn1cc(-c2c[nH]c(C(=O)C=O)c2-c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCG P05129 11/20 0.64
PRKCB P05771 11/20 0.64
PRKCA P17252 11/20 0.64
PRKCE Q02156 11/20 0.64
PRKCH P24723 10/20 0.64
PRKCD Q05655 10/20 0.64
CAMK2D Q13557 9/20 0.64
CAMK2B Q13554 8/20 0.64
CAMK2G Q13555 8/20 0.64
CAMK2A Q9UQM7 8/20 0.64
PRKCZ Q05513 7/20 0.64
PIP5K1C O60331 1/20 0.64
RPS6KA5 O75582 1/20 0.64
RPS6KA4 O75676 1/20 0.64
STK16 O75716 1/20 0.64
PAK3 O75914 1/20 0.64
CDK14 O94921 1/20 0.64
MET P08581 1/20 0.64
PDGFRB P09619 1/20 0.64
KIT P10721 1/20 0.64

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
Hydrochloric Acid SCHEMBL27993565 0.99 PRKCG (0.65) PRKCGPRKCBPRKCAPRKCEPRKCH
Hydrochloric Acid SCHEMBL29784988 0.84 PRKCG (0.77) PRKCGPRKCBPRKCAPRKCEPRKCH
Enzastaurin SCHEMBL29356867 0.79 PRKCG (1.00) PRKCGPRKCBPRKCAPRKCEPRKCH
Enzastaurin SCHEMBL678748 0.79 PRKCG (1.00) PRKCGPRKCBPRKCAPRKCEPRKCH
Enzastaurin SCHEMBL29371538 0.79 PRKCG (1.00) PRKCGPRKCBPRKCAPRKCEPRKCH
Enzastaurin SCHEMBL16934851 0.78 PRKCG (1.00) PRKCGPRKCBPRKCAPRKCEPRKCH
Enzastaurin SCHEMBL4325665 0.78 PRKCG (0.98) PRKCGPRKCBPRKCAPRKCEPRKCH
Enzastaurin SCHEMBL4877354 0.78 PRKCG (1.00) PRKCGPRKCBPRKCAPRKCEPRKCH
Enzastaurin SCHEMBL29371570 0.78 PRKCG (1.00) PRKCGPRKCBPRKCAPRKCEPRKCH
SCHEMBL23299739 0.76 PRKCG (0.68) PRKCGPRKCBPRKCAPRKCEPRKCH

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-109952383-A Methods and compositions for predicting enzastaurin activity 索元生物医药有限公司 2019-06-28 CN disclosed