SCHEMBL4667735

SCHEMBL4667735

COc1cccc(CNC(=O)/C=C/c2n[nH]c3ncccc23)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ THRB P10828 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ LIPG Q9Y5X9 1/20 0.48
▸ MAPT P10636 2/20 0.48
▸ ALOX15 P16050 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ HDAC3 O15379 1/20 0.47
▸ HDAC1 Q13547 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ EPHX2 P34913 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ FGFR1 P11362 1/20 0.46
▸ FGFR4 P22455 1/20 0.46
▸ HTT P42858 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
SCHEMBL4667740 1.00 HPGD (0.52) HPGDKMT2ATHRBSMN1; SMN2LIPG
SCHEMBL4667886 0.89 THRB (0.56) HPGDKMT2ATHRBSMN1; SMN2MAPT
SCHEMBL4667888 0.89 THRB (0.56) HPGDKMT2ATHRBSMN1; SMN2MAPT
SCHEMBL4667875 0.85 KDR (0.49) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL4666551 0.85 NPSR1 (0.51) HPGDSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL4667873 0.85 KDR (0.49) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL4666548 0.85 NPSR1 (0.51) HPGDSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL4669121 0.84 MMP1 (0.53) KMT2ATHRBSMN1; SMN2MAPTLMNA
SCHEMBL4669118 0.84 MMP1 (0.53) KMT2ATHRBSMN1; SMN2MAPTLMNA
SCHEMBL4350169 0.82 FGFR1 (0.56) HPGDKMT2ATHRBSMN1; SMN2LIPG

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-1980561-B1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-09 — — EP claimed
EP-1980561-A1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-10-15 — — EP claimed
EP-1980561-B1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-09 — — EP disclosed
EP-1980561-A1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-10-15 — — EP disclosed
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