SCHEMBL6537375

SCHEMBL6537375

O=C(Nc1cccc2c(NCCc3ccccc3)ccnc12)c1c(Cl)cccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 6/20 0.48
CDK8 P49336 6/20 0.48
JAK2 O60674 3/20 0.48
TYK2 P29597 3/20 0.48
JAK1 P23458 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.46
HSD17B10 Q99714 1/20 0.46
RAB9A P51151 2/20 0.45
POLB P06746 2/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
RCE1 Q9Y256 1/20 0.45
KDR P35968 2/20 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
SCHEMBL6537556 0.89 JAK2 (0.46) JAK2TYK2JAK1SMN1; SMN2KDM4E
SCHEMBL6538110 0.85 TYK2 (0.51) JAK2TYK2JAK1SMN1; SMN2KDM4E
SCHEMBL6537677 0.84 SMN1; SMN2 (0.52) JAK2TYK2JAK1SMN1; SMN2KDM4E
SCHEMBL6537898 0.83 SMN1; SMN2 (0.70) JAK2TYK2JAK1SMN1; SMN2KDM4E
SCHEMBL6538010 0.83 SMN1; SMN2 (0.52) JAK2TYK2JAK1SMN1; SMN2KDM4E
SCHEMBL6538261 0.83 SLC40A1 (0.55) JAK2TYK2JAK1SMN1; SMN2KDM4E
SCHEMBL6537338 0.83 SMN1; SMN2 (0.50) JAK2TYK2JAK1SMN1; SMN2KDM4E
SCHEMBL7504935 0.82 SMN1; SMN2 (0.63) CCNCCDK8SMN1; SMN2KDM4EALDH1A1
SCHEMBL6538018 0.82 JAK2 (0.48) JAK2TYK2JAK1ALDH1A1HTT
SCHEMBL7505373 0.81 LMNA (0.59) CCNCCDK8SMN1; SMN2KDM4EALDH1A1

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