SCHEMBL6537704

SCHEMBL6537704

COCc1cnc2c(N)ccc(C)c2c1Cl

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
KDM4E B2RXH2 1/20 0.35
PDE10A Q9Y233 1/20 0.33
DHFR P00374 1/20 0.33
CYP3A4 P08684 1/20 0.32
SLC6A2 P23975 2/20 0.30
SLC6A4 P31645 2/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL6538000 0.79 KMT2A (0.38) LMNAKDM4E
SCHEMBL6538359 0.78 CYP3A4 (0.39) LMNAKDM4ECYP3A4
SCHEMBL6538051 0.75 G6PD (0.43) LMNAKDM4EPDE10A
SCHEMBL6536893 0.71 LMNA (0.42) LMNAKDM4EPDE10A
SCHEMBL6537547 0.71 PTGES (0.42) CYP3A4
SCHEMBL6538129 0.67 AXL (0.35) KDM4ECYP3A4
SCHEMBL6537500 0.65 NR4A2 (0.41) LMNAKDM4ECYP3A4
SCHEMBL6537788 0.62 G6PD (0.39) KDM4EPDE10A
SCHEMBL24737890 0.62 LMNA (0.51) LMNAKDM4E
SCHEMBL9078719 0.61 IDO1 (0.46) LMNACYP3A4

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-0876345-B1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO (JP) 2004-08-18 EP disclosed
US-6008230-A TREATING BONE DISEASES CAUSED BY ABNORMAL BONE METABOLISM IN HUMAN BEING OR ANIMALS AS THE INHIBITORS OF BONE RESORPTION OR THE INHIBITORS OF BONE METASTASIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed
EP-0876345-A1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-11 EP disclosed
WO-1997014681-A1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-04-24 WO disclosed