SCHEMBL8920197

SCHEMBL8920197

CN1CCC(N2C(=O)C(c3c[nH]c4ccccc34)=C(c3cn(C)c4ccccc34)C2=O)CC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 2/20 0.66
CDK9 P50750 2/20 0.66
PIM1 P11309 1/20 0.66
CAMK2D Q13557 8/20 0.66
PRKCG P05129 6/20 0.66
PRKCB P05771 6/20 0.66
PRKCA P17252 6/20 0.66
PRKCH P24723 6/20 0.66
PRKCE Q02156 6/20 0.66
PRKCZ Q05513 6/20 0.66
PRKCD Q05655 6/20 0.66
CAMK2B Q13554 6/20 0.66
CAMK2G Q13555 6/20 0.66
CAMK2A Q9UQM7 6/20 0.66
SRC P12931 3/20 0.66
PRKACA P17612 5/20 0.62
PRKACG P22612 5/20 0.62
PRKACB P22694 5/20 0.62
CCNE2 O96020 4/20 0.62
CDK4 P11802 4/20 0.62

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
SCHEMBL8920763 0.90 CCNT1 (0.61) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL8921039 0.88 CAMK2D (0.61) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL7195523 0.82 CCNT1 (0.81) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL30834685 0.78 CCNT1 (0.74) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL7822250 0.77 CDK4 (1.00) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL7831969 0.77 PRKACA (0.77) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL18392163 0.75 CDK4 (0.68) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL8482614 0.73 PIM1 (0.66) CCNT1CDK9PIM1CAMK2DPRKCG
SCHEMBL3146547 0.73 PRKCB (1.00) CDK9PIM1CAMK2DPRKCGPRKCB
SCHEMBL8482796 0.72 CCNT1 (0.65) CCNT1CDK9PIM1CAMK2DPRKCG

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
US-5672618-A TREATING DIABETIC COMPLICATIONS ELI LILLY AND COMPANY (US) 1997-09-30 US disclosed