SCHEMBL13625405

SCHEMBL13625405

Cc1ccc(-c2nc3c4ccccc4c4ccccc4c3n2C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
TLR7 Q9NYK1 1/20 0.43
ALDH1A1 P00352 7/20 0.42
HSD17B10 Q99714 2/20 0.42
TSHR P16473 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.39
ADORA2A P29274 3/20 0.39
ADORA2B P29275 2/20 0.39
DHODH Q02127 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RXFP1 Q9HBX9 2/20 0.38
ADORA3 P0DMS8 1/20 0.38

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
SCHEMBL822576 0.90 HPGD (0.55) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL16692184 0.87 KDM4E (0.50) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL762312 0.87 KDM4E (0.50) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL16692125 0.84 KDM4E (0.48) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL16692180 0.84 KDM4E (0.48) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL15763114 0.84 KDM4E (0.55) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL762055 0.84 KMT2A (0.50) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL762117 0.83 KDM4E (0.50) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL763127 0.83 KDM4E (0.60) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL763102 0.83 KDM4E (0.47) KDM4EMEN1KMT2AMAPTHPGD

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
WO-2009141236-A1 SPIROPYRANS HAVING FLUOROPHORIC GROUPS BASF SE (DE) 2009-11-26 WO disclosed