SCHEMBL4666545

SCHEMBL4666545

O=C(C=Cc1n[nH]c2ncccc12)NCc1ccccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
KDM4E B2RXH2 3/20 0.41
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40
GABRA6 Q16445 1/20 0.40
GABRG1 Q8N1C3 1/20 0.40
GABRG3 Q99928 1/20 0.40
GABRQ Q9UN88 1/20 0.40
CDC7 O00311 1/20 0.40
CCNE1 P24864 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
SCHEMBL4666544 1.00 LMNA (0.46) LMNAKDM4EGABRPGABRDGABRA1
SCHEMBL4668091 0.89 HDAC1 (0.41) LMNAKDM4EKDRMEN1KMT2A
SCHEMBL4666591 0.89 P2RX7 (0.43) KDM4EP2RX7MAPK1GSK3B
SCHEMBL4668094 0.89 HDAC1 (0.41) LMNAKDM4EKDRMEN1KMT2A
SCHEMBL4666586 0.89 P2RX7 (0.43) KDM4EP2RX7MAPK1GSK3B
SCHEMBL4668115 0.89 SMN1; SMN2 (0.39) LMNAKDRP2RX7POLBMAPK1
SCHEMBL4668112 0.89 SMN1; SMN2 (0.39) LMNAKDRP2RX7POLBMAPK1
SCHEMBL4665993 0.87 MEN1 (0.49) LMNAP2RX7MEN1KMT2AMAPK1
SCHEMBL4666003 0.87 MEN1 (0.49) LMNAP2RX7MEN1KMT2AMAPK1
SCHEMBL4669121 0.86 MMP1 (0.53) LMNAKDM4EPOLBMEN1KMT2A

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