SCHEMBL6537542

SCHEMBL6537542

COCc1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1C(O[SiH](c1ccccc1)c1ccccc1)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 7/20 0.36
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
POLB P06746 1/20 0.34
SLC16A3 O15427 1/20 0.34
NPC1 O15118 2/20 0.33
RIPK1 Q13546 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
PABPC1 P11940 1/20 0.32
EIF4H Q15056 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
EPHB3 P54753 1/20 0.32
GHSR Q92847 1/20 0.32

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
SCHEMBL6537507 0.93 SLC16A3 (0.36) MEN1KMT2APOLBSLC16A3NPC1
SCHEMBL6537405 0.91 SLC16A3 (0.35) MEN1KMT2APOLBSLC16A3NPC1
SCHEMBL6537960 0.87 SLC16A3 (0.38) MEN1KMT2APOLBSLC16A3NPC1
SCHEMBL8471309 0.86 KMT2A (0.34) MEN1KMT2APOLBSLC16A3JAK2
SCHEMBL6537654 0.83 KMT2A (0.35) PTGESMEN1KMT2APOLBSLC16A3
SCHEMBL6537759 0.79 PTGES (0.44) PTGESMEN1KMT2APOLBSLC16A3
SCHEMBL6537544 0.78 PTGES (0.37) PTGESMEN1KMT2APOLBSLC16A3
SCHEMBL6537695 0.78 PTGES (0.44) PTGESMEN1KMT2APOLBSLC16A3
SCHEMBL8588646 0.77 SLC16A3 (0.39) MEN1KMT2APOLBSLC16A3JAK2
SCHEMBL6538012 0.77 PTGES (0.42) PTGESMEN1KMT2APOLBSLC16A3

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