SCHEMBL13615233

SCHEMBL13615233

Cc1ccc2cc(-c3ccc4cnccc4c3)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 1/20 0.53
CYP2A6 P11509 3/20 0.50
IMPDH2 P12268 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP11B2 P19099 7/20 0.46
CYP11B1 P15538 6/20 0.46
CYP19A1 P11511 4/20 0.46
CYP17A1 P05093 3/20 0.46
TDO2 P48775 1/20 0.45
ALOX15 P16050 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
DYRK3 O43781 1/20 0.43
ROCK2 O75116 1/20 0.43
PRKD3 O94806 1/20 0.43
MAP4K4 O95819 1/20 0.43
CDK1 P06493 1/20 0.43
ROS1 P08922 1/20 0.43
PIM1 P11309 1/20 0.43
PRKACA P17612 1/20 0.43
RPS6KB1 P23443 1/20 0.43

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
SCHEMBL23555375 0.92 PRKCZ (0.58) PRKCZIMPDH2CYP11B2CYP11B1CYP19A1
SCHEMBL8338721 0.92 PRKCZ (0.58) PRKCZIMPDH2CYP11B2CYP11B1CYP19A1
SCHEMBL2616771 0.92 CYP2A6 (0.59) PRKCZCYP2A6IMPDH2CYP1A2CYP19A1
SCHEMBL30969150 0.92 CYP2A6 (0.59) PRKCZCYP2A6IMPDH2CYP1A2CYP19A1
SCHEMBL28302611 0.87 PRKCZ (0.56) PRKCZIMPDH2CYP11B2CYP11B1CYP19A1
SCHEMBL8338092 0.85 PRKCZ (0.68) PRKCZIMPDH2CYP1A2CYP11B2CYP11B1
SCHEMBL23555378 0.85 PRKCZ (0.68) PRKCZIMPDH2CYP1A2CYP11B2CYP11B1
SCHEMBL24621868 0.84 CYP2A6 (0.54) PRKCZCYP2A6IMPDH2CYP1A2CYP19A1
SCHEMBL13670757 0.84 CYP2A6 (0.54) PRKCZCYP2A6IMPDH2CYP1A2CYP19A1
SCHEMBL9887365 0.84 CYP2A6 (0.54) CYP2A6CYP1A2CYP11B2CYP11B1CYP19A1

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-7611863-B2 Selective staining of biomembranes using voltage-sensitive dyes MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2009-11-03 US disclosed