SCHEMBL8522348

SCHEMBL8522348

Cc1[nH]c2ccccc2c1C1=C(c2c(Cc3cc(C=N)ccc3Br)[nH]c3ccccc23)C(=O)NC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 6/20 0.41
PRKCB P05771 1/20 0.38
PRKCA P17252 1/20 0.38
PRKCH P24723 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCD Q05655 1/20 0.38
CDK4 P11802 5/20 0.34
CCND1 P24385 5/20 0.34
CCNE2 O96020 4/20 0.34
CCNE1 P24864 4/20 0.34
CDK2 P24941 4/20 0.34
CAMK2B Q13554 4/20 0.34
CAMK2G Q13555 4/20 0.34
CAMK2A Q9UQM7 4/20 0.34
CCNB2 O95067 3/20 0.34
CDK1 P06493 3/20 0.34
CCNB1 P14635 3/20 0.34
CCNB3 Q8WWL7 3/20 0.34
CCNT1 O60563 1/20 0.34

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 SCHEMBL8316034 0.82 CAMK2D (0.45) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL8578932 0.76 CAMK2D (0.44) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL5686050 0.74 CAMK2D (0.57) CAMK2DPRKCBPRKCAPRKCHPRKCE
Hydrochloric Acid SCHEMBL8319189 0.73 PRKCB (0.49) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL5683201 0.73 CAMK2D (0.50) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL8316483 0.73 CAMK2D (0.51) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL8317050 0.72 CAMK2D (0.45) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL8317078 0.72 CAMK2D (0.48) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL19217026 0.72 CAMK2D (0.50) CAMK2DPRKCBPRKCAPRKCHPRKCE
Hydrochloric Acid SCHEMBL8316493 0.72 CAMK2D (0.42) CAMK2DPRKCBPRKCAPRKCHPRKCE

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 claimed
WO-1998011102-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRA AKTIEBOLAG (SE) 1998-03-19 WO claimed