SCHEMBL7776256

SCHEMBL7776256

CCc1nc2cnccc2n1-c1ccc(Cn2c(=O)sc3ccccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.49
L3MBTL1 Q9Y468 4/20 0.49
KDM4E B2RXH2 1/20 0.49
PKM P14618 1/20 0.49
POLB P06746 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
LMNA P02545 2/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
USP2 O75604 2/20 0.45
GLA P06280 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
THRB P10828 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL6705396 0.90 L3MBTL1 (0.51) TP53L3MBTL1KDM4EPKMPOLB
SCHEMBL7774894 0.85 L3MBTL1 (0.50) TP53L3MBTL1KDM4EPKMPOLB
SCHEMBL7774780 0.82 MEN1 (0.44)
SCHEMBL7774801 0.80 TP53 (0.47) TP53L3MBTL1KDM4EPKMPOLB
SCHEMBL7776564 0.78
SCHEMBL7776541 0.78
SCHEMBL7774882 0.78 BRD4 (0.45)
SCHEMBL7776418 0.78 BRD4 (0.45)
SCHEMBL7770160 0.77 L3MBTL1 (0.41) L3MBTL1KDM4EPKMPOLBLMNA
SCHEMBL7770192 0.77 BRD4 (0.39)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1125936-A2 Aryl substituted azabenzimidazoles and their use in the treatment of HIV and AIDS related diseases Pfizer Products Inc. (US) 2001-08-22 EP claimed
US-6242461-B1 Use of aryl substituted azabenzimidazoles in the treatment of HIV and AIDS related diseases PFIZER INC. 2001-06-05 US claimed
EP-1125936-A2 Aryl substituted azabenzimidazoles and their use in the treatment of HIV and AIDS related diseases Pfizer Products Inc. (US) 2001-08-22 EP disclosed
US-6242461-B1 Use of aryl substituted azabenzimidazoles in the treatment of HIV and AIDS related diseases PFIZER INC. 2001-06-05 US disclosed