SCHEMBL18435652

SCHEMBL18435652

Ic1ccc(-n2c3ccccc3c3ccc4c5ccccc5sc4c32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.39
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TP53 P04637 2/20 0.35
GPR3 P46089 1/20 0.35
HSD17B10 Q99714 1/20 0.33
RXFP1 Q9HBX9 2/20 0.32
MAPT P10636 4/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
ALOX5 P09917 1/20 0.31
MPO P05164 1/20 0.31
CHEK1 O14757 1/20 0.31
AURKA O14965 1/20 0.31
NTRK1 P04629 1/20 0.31
FYN P06241 1/20 0.31

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
SCHEMBL10014576 0.93 ATM (0.44) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL17246454 0.91 ATM (0.47) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL10014577 0.89 ATM (0.41) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL24923497 0.89 ATM (0.41) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL10014564 0.88 ATM (0.52) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL22710508 0.87 ATM (0.43) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL24173611 0.87 ATM (0.43) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL24218141 0.86 KDM4E (0.39) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL24218051 0.86 MAPT (0.40) ATMKDM4EL3MBTL1TP53GPR3
SCHEMBL15747055 0.86 KDM4E (0.39) ATMKDM4EL3MBTL1TP53GPR3

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-3124488-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2017-02-01 EP disclosed