SCHEMBL7881995

SCHEMBL7881995

N=C(N)NC(=O)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.59
F3 P13726 1/20 0.59
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
RXFP1 Q9HBX9 1/20 0.56
SMYD3 Q9H7B4 1/20 0.56
NHERF1 O14745 6/20 0.55
PYGL P06737 4/20 0.55
HRH4 Q9H3N8 3/20 0.54
HRH3 Q9Y5N1 1/20 0.54
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
GUSB P08236 2/20 0.52

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
Hydrochloric Acid SCHEMBL7879661 0.99 F7 (0.57) F7F3MEN1KMT2ARXFP1
SCHEMBL8170113 0.84 F7 (0.57) F7F3MEN1KMT2ARXFP1
SCHEMBL4933623 0.82 F7 (0.66) F7F3MEN1KMT2ARXFP1
SCHEMBL1952751 0.81 KDM4E (0.67) NPC1RAB9A
SCHEMBL764543 0.80 F7 (0.72) F7F3MEN1KMT2ARXFP1
Hydrochloric Acid SCHEMBL7884810 0.79 KDM4E (0.65) NPC1RAB9A
SCHEMBL27464367 0.79 F7 (0.66) F7F3MEN1KMT2ARXFP1
SCHEMBL12101200 0.79 ALOX15 (0.77) F7F3MEN1KMT2ARXFP1
SCHEMBL6162686 0.79 PYGL (0.65) NHERF1PYGLHRH4HRH3
SCHEMBL27477428 0.79 F7 (0.57) F7F3MEN1KMT2ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114393-A ADMINISTERING A BENZOYLGUANIDINE COMPOUND ANTIPROTOZOA AGENT HOECHST MARION ROUSSEL DEUTSCHLAND GMBH (DE) 2000-09-05 US claimed
EP-0901788-A2 Use of inhibitors of the sodium hydrogen exchange in the manufacture of a medicament Hoechst Marion Roussel Deutschland GmbH (DE) 1999-03-17 EP claimed
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
US-6114393-A ADMINISTERING A BENZOYLGUANIDINE COMPOUND ANTIPROTOZOA AGENT HOECHST MARION ROUSSEL DEUTSCHLAND GMBH (DE) 2000-09-05 US disclosed
EP-0901788-A2 Use of inhibitors of the sodium hydrogen exchange in the manufacture of a medicament Hoechst Marion Roussel Deutschland GmbH (DE) 1999-03-17 EP 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