SCHEMBL8315735

SCHEMBL8315735

Cc1[nH]c2ccccc2c1C1=C(c2c(Cc3cccc(CN(C)C)c3)[nH]c3ccccc23)C(=O)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCB P05771 6/20 0.43
PRKCA P17252 6/20 0.43
PRKCH P24723 6/20 0.43
PRKCE Q02156 6/20 0.43
PRKCQ Q04759 6/20 0.43
PRKCD Q05655 6/20 0.43
CAMK2D Q13557 2/20 0.43
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CDK2 P24941 1/20 0.38
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
PARP1 P09874 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL8317497 0.90 CYP3A4 (0.45) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL8317078 0.87 CAMK2D (0.48) PRKCBPRKCAPRKCHPRKCEPRKCQ
Hydrochloric Acid SCHEMBL8318720 0.86 CAMK2D (0.48) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL8316483 0.81 CAMK2D (0.51) PRKCBPRKCAPRKCHPRKCEPRKCQ
Hydrochloric Acid SCHEMBL8316493 0.80 CAMK2D (0.42) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL8317092 0.79 ROCK2 (0.45) PRKCBPRKCACAMK2DMAPTHSD17B10
SCHEMBL8319658 0.79 ROCK2 (0.45) PRKCBPRKCACAMK2DMAPTHSD17B10
SCHEMBL8314832 0.79 CAMK2D (0.43) PRKCBPRKCAPRKCHPRKCEPRKCQ
Hydrochloric Acid SCHEMBL8319262 0.78 ROCK2 (0.44) PRKCBPRKCACAMK2DMAPTHSD17B10
Hydrochloric Acid SCHEMBL8317707 0.78 CAMK2D (0.42) PRKCBPRKCAPRKCHPRKCEPRKCQ

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
EP-0925296-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS Astra Aktiebolag (SE) 1999-06-30 EP disclosed
WO-1998011102-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRA AKTIEBOLAG (SE) 1998-03-19 WO disclosed