SCHEMBL7873284

SCHEMBL7873284

CN(C(=N)N)C(=O)c1cc2c(Cl)cc(Oc3cccnc3)cc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
CHEK2 O96017 1/20 0.39
IDO1 P14902 1/20 0.39
RHEB Q15382 2/20 0.38
BTK Q06187 1/20 0.36
GRM5 P41594 2/20 0.36
TDP1 Q9NUW8 2/20 0.35
HTT P42858 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL7873184 0.88 RHEB (0.38) CHEK2IDO1RHEB
SCHEMBL7879889 0.88 RHEB (0.50) RHEB
SCHEMBL7880736 0.86 SMN1; SMN2 (0.39) DRD2DRD3CHEK2IDO1RHEB
SCHEMBL7880774 0.85 RHEB (0.32) RHEB
SCHEMBL7882347 0.84 RHEB (0.39) CHEK2RHEB
Hydrochloric Acid SCHEMBL7873497 0.83 RHEB (0.39) CHEK2RHEB
SCHEMBL7877721 0.83 BTK (0.45) DRD2DRD3CHEK2IDO1BTK
SCHEMBL7881123 0.83 RHEB (0.33) IDO1RHEB
SCHEMBL7884372 0.83 RHEB (0.39) CHEK2RHEBALDH1A1
SCHEMBL7879857 0.83 SMN1; SMN2 (0.37) DRD2DRD3RHEBGRM5ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248772-B1 HYPOTENSIVE AGENTS; ANTIARRHYTHMIA AGENTS; ANTIDIABETIC AGENTS; ANTIPROLIFERATIVE AGENTS SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2001-06-19 US disclosed
US-6169107-B1 USEFUL FOR THE TREATMENT AND PREVENTION OF DISEASES CAUSED BY INCREASED SODIUM/PROTON (NA.SUP.+ /H.SUP.+) EXCHANGER ACTIVITY, FOR EXAMPLE, HYPERTENSION, ARRHYTHMIA, ANGINA PECTORIS, CARDIAC HYPERTROPHY, DIABETES MELLITUS SUMITOMO PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US disclosed
EP-0708091-A2 Indoloylguanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-04-24 EP disclosed