SCHEMBL30366127

SCHEMBL30366127

Cc1cc(Cl)cnc1C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
NPSR1 Q6W5P4 2/20 0.49
USP2 O75604 1/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MAPT P10636 3/20 0.49
KDM4E B2RXH2 1/20 0.49
THRB P10828 1/20 0.49
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
STS P08842 1/20 0.47
CNR1 P21554 2/20 0.46
GPR119 Q8TDV5 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL30899639 1.00 MEN1 (0.49) MEN1KMT2ANPSR1USP2HPGD
SCHEMBL20135077 0.89 MAPT (0.52) MEN1KMT2AMAPTKDM4ETHRB
SCHEMBL2681920 0.87 MEN1 (0.48) MEN1KMT2ANPSR1USP2HPGD
SCHEMBL12211468 0.87 MEN1 (0.48) MEN1KMT2ANPSR1USP2HPGD
SCHEMBL15167906 0.86 MAPT (0.49) HPGDMAPTKDM4ETHRBTP53
SCHEMBL15180524 0.85 TP53 (0.48) MEN1KMT2AHPGDMAPTKDM4E
SCHEMBL30366132 0.84 USP30 (0.42) MEN1KMT2ANPSR1USP2HPGD
SCHEMBL30456267 0.83 GPR119 (0.52) MAPTKDM4ETHRBGPR119
SCHEMBL25723292 0.83 GPR119 (0.52) MAPTKDM4ETHRBGPR119
SCHEMBL31701805 0.82 GPR119 (0.49) MEN1KMT2AMAPTKDM4ETHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4405051-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2024-07-31 EP disclosed
WO-2023046806-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2023-03-30 WO disclosed