SCHEMBL3940928

SCHEMBL3940928

COc1ccc(Cn2cccn2)c(S(C)(=O)=O)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KAT7 O95251 13/20 0.47
KAT6A Q92794 13/20 0.47
KAT6B Q8WYB5 8/20 0.47
KAT5 Q92993 5/20 0.47
KAT8 Q9H7Z6 5/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
PDE4B Q07343 1/20 0.40

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
SCHEMBL29008820 0.80 KDM4E (0.52) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL27760047 0.79 KDM4E (0.49) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL28557215 0.79 MAPT (0.46) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL27766479 0.78 POLB (0.41) KAT7KAT6ALMNAHTTALDH1A1
SCHEMBL28557207 0.74 KAT7 (0.47) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31516718 0.72 KAT7 (0.51) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31516659 0.72 KAT7 (0.47) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL4796562 0.72 GAA (0.48) KAT7KAT6ALMNAMAPTHTT
SCHEMBL3319825 0.71 MAPT (0.55) KAT7KAT6AMAPTHTTALDH1A1
SCHEMBL22317331 0.71 HTT (0.55) KAT7KAT6ALMNAHTT

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-2108020-A2 1-H-PYRAZOLO[3,4B]PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES Biogen Idec MA, Inc. (US) 2009-10-14 EP disclosed
EP-2108019-A2 1-H-PYRAZOLO[3,4B]PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES Biogen Idec MA, Inc. (US) 2009-10-14 EP disclosed
WO-2008094602-A2 1-H-PYRAZOLO (3,4B) PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES BIOGEN IDEC MA INC. (US) 2008-08-07 WO disclosed
WO-2008094575-A2 1-H-PYRAZOLO(3,4B)PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES BIOGEN IDEC MA INC. (US) 2008-08-07 WO disclosed