SCHEMBL7877646

SCHEMBL7877646

CCN(CC)CCCOc1ccc(OC(C)C)c2cc(C(=O)N=C(N)NC)[nH]c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.36
HRH3 Q9Y5N1 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ACHE P22303 3/20 0.33
BCHE P06276 1/20 0.33
MCHR1 Q99705 2/20 0.33
LMNA P02545 1/20 0.32
MC4R P32245 2/20 0.32
KDR P35968 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAOA P21397 1/20 0.32
CYP2C19 P33261 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
SCHEMBL7884650 0.91 KDM4E (0.38) HRH3KDM4EALDH1A1TDP1LMNA
SCHEMBL7881951 0.90 KDM4E (0.42) KDM4EALDH1A1TDP1MEN1KMT2A
SCHEMBL7879685 0.88 ALDH1A1 (0.38) MAOBHRH3KDM4EALDH1A1TDP1
SCHEMBL7877510 0.88 KDM4E (0.34) KDM4EALDH1A1TDP1MEN1GAA
Hydrochloric Acid SCHEMBL7884702 0.87 KDM4E (0.37) MAOBHRH3KDM4EALDH1A1TDP1
Hydrochloric Acid SCHEMBL7881266 0.87 KDM4E (0.33) KDM4EALDH1A1TDP1LMNA
Hydrochloric Acid SCHEMBL7884823 0.86 KDM4E (0.38) MAOBHRH3KDM4EALDH1A1TDP1
SCHEMBL7884737 0.83 ULK1 (0.46) MAOBHRH3ALDH1A1MEN1GAA
SCHEMBL7877563 0.82 HTR1B (0.38) MAOBKDM4EALDH1A1TDP1ACHE
SCHEMBL7879694 0.82 ALDH1A1 (0.40) MAOBHRH3KDM4EALDH1A1MEN1

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 5 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-0622356-B1 Indoloylguanidine derivatives as inhibitors of sodium-hydrogen exchange SUMITOMO PHARMA (JP) 1998-07-01 EP disclosed
EP-0708091-A2 Indoloylguanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-04-24 EP disclosed
EP-0622356-A1 Indoloylguanidine derivatives as inhibitors of sodium-hydrogen exchange SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1994-11-02 EP disclosed