SCHEMBL6537870

SCHEMBL6537870

O=C(Nc1cccc2cc(Br)cnc12)c1ccccc1C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
RXFP1 Q9HBX9 1/20 0.51
PTGES O14684 9/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
KDR P35968 3/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
PTGS1 P23219 1/20 0.46
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
CBR1 P16152 1/20 0.44
AKR1C3 P42330 1/20 0.44

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
SCHEMBL6537944 0.82 RAB9A (0.56) SMN1; SMN2L3MBTL1KDRKDM4EMAPT
SCHEMBL6537959 0.82 RAB9A (0.56) SMN1; SMN2L3MBTL1KDRGAAKDM4E
SCHEMBL6537606 0.82 KDR (0.67) SMN1; SMN2PTGESL3MBTL1KDRKDM4E
SCHEMBL7522656 0.82 MAPT (0.68) SMN1; SMN2PTGESL3MBTL1KDRGAA
SCHEMBL30733219 0.82 MAPT (0.68) SMN1; SMN2PTGESL3MBTL1KDRGAA
SCHEMBL6537986 0.81 KDR (0.50) SMN1; SMN2RXFP1L3MBTL1KDRGAA
SCHEMBL6537919 0.80 CYP1A2 (0.55) SMN1; SMN2L3MBTL1LMNAKDM4EMAPT
SCHEMBL6537751 0.80 RAB9A (0.69) SMN1; SMN2RXFP1GAAKCNK3KCNK9
SCHEMBL6537757 0.78 KDR (0.58) SMN1; SMN2RXFP1L3MBTL1KDRGAA
SCHEMBL6537536 0.77 KDR (0.52) SMN1; SMN2L3MBTL1KDRLMNAGAA

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