SCHEMBL9626477

SCHEMBL9626477

CCNc1cccc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.50
IDO1 P14902 2/20 0.49
EDNRA P25101 1/20 0.46
CYP1A2 P05177 3/20 0.46
SNCA P37840 2/20 0.40
NSD2 O96028 1/20 0.39
CHAT P28329 1/20 0.39
FABP4 P15090 1/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
MAPK14 Q16539 1/20 0.39
NR4A1 P22736 1/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL27435036 0.90 IDO1 (0.57) TTRIDO1EDNRACYP1A2SNCA
SCHEMBL5022978 0.84 CNR1 (0.49) TTRIDO1CYP1A2MEN1TP53
SCHEMBL5016478 0.84 CNR1 (0.52) TTRIDO1CYP1A2MEN1TP53
SCHEMBL15282372 0.84 TTR (0.47) TTREDNRACYP1A2SNCANSD2
SCHEMBL12221061 0.83 TTR (0.46) TTRIDO1CYP1A2SNCANSD2
SCHEMBL4726651 0.82 TTR (0.42) TTRIDO1FABP4CCNA2CDK2
SCHEMBL7757566 0.82 TTR (0.56) TTRIDO1EDNRACYP1A2SNCA
SCHEMBL5024402 0.82 CYP1A2 (0.43) TTRIDO1EDNRACYP1A2SNCA
SCHEMBL12041809 0.81 TTR (0.45) TTRIDO1EDNRACYP1A2SNCA
SCHEMBL5016504 0.81 CYP1A2 (0.42) TTRIDO1EDNRACYP1A2SNCA

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
EP-0205005-B1 NEW BIOLOGICALLY ACTIVE FLUORESCENT CYCLIC NUCLEOTIDES UNIVERSITA' DEGLI STUDI DI PARMA (IT) 1992-05-13 EP claimed