SCHEMBL10713699

SCHEMBL10713699

NC(=O)c1ccc(OCCNCc2ccccc2)cc1O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 6/20 0.63
DRD2 P14416 4/20 0.62
DRD3 P35462 4/20 0.62
ADRA1D P25100 1/20 0.62
ADRA1A P35348 1/20 0.62
ADRA1B P35368 1/20 0.62
PPARG P37231 1/20 0.58
KMT2A Q03164 1/20 0.53
MAOB P27338 1/20 0.50
KDM4E B2RXH2 3/20 0.49
LMNA P02545 1/20 0.49
MITF O75030 1/20 0.49
GAA P10253 1/20 0.49
MAPK1 P28482 1/20 0.48

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
SCHEMBL11088265 0.96 DRD4 (0.58) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL10714100 0.90 DRD4 (0.59) DRD4DRD2DRD3ADRA1DADRA1A
Hydrochloric Acid SCHEMBL10715208 0.89 DRD4 (0.58) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL10957903 0.84 DRD4 (0.55) DRD4DRD2DRD3ADRA1DADRA1A
Hydrochloric Acid SCHEMBL10959588 0.83 DRD4 (0.54) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL10715040 0.83 KDM4E (0.58) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL4024256 0.81 DRD4 (0.46) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL7907691 0.81 MAOB (0.73) KMT2AMAOBLMNA
SCHEMBL11086087 0.81 ALOX15 (0.58) DRD4DRD2DRD3KDM4EGAA
SCHEMBL11089177 0.81 ALOX15 (0.55) DRD4DRD2DRD3KMT2AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4727067-A TREATMENT OF ANGINA PECTORIS, CARDIAC ARRHYTHMIA, HYPERTENSION, DEPRESSION CIBA-GEIGY CORPORATION (US) 1988-02-23 US disclosed
US-4636511-A ANTIARRHYTHMIC, HYPOTENSIVE CIBA-GEIGY AG (US) 1987-01-13 US disclosed
EP-0039892-B1 SUBSTITUTED PHENYL ETHERS CIBA-GEIGY AG (CH) 1986-12-30 EP disclosed
US-4559354-A ADRENERGIC BLOCKING AGENTS AND STIMULANTS; CARDIOTONIC, ANTIARRHYTHMIA AND INOTROPIC AGENTS CIBA-GEIGY CORPORATION (US) 1985-12-17 US disclosed
US-4497813-A ANTIARRHYTHMIA AGENTS, HYPOTENSIVE AGENTS, ANTIDEPRESSANTS CIBA-GEIGY CORPORATION (US) 1985-02-05 US disclosed
EP-0015505-B1 3-AMINO-1,2-PROPANE DIOLS, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND USE THEREOF CIBA-GEIGY AG (CH) 1984-08-08 EP disclosed
US-4460580-A N-Alkylated aminoalcohols and their pharmaceutical compositions useful for the treatment of cardiac insufficiency CIBA-GEIGY CORPORATION (US) 1984-07-17 US disclosed
EP-0069838-A1 Aralkylamino-ethoxy salicyl amides, and their pharmaceutical use CIBA-GEIGY AG (CH) 1983-01-19 EP disclosed
EP-0005848-B1 N-ALKYLATED AMINOALCOHOLS AND THEIR SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1981-12-30 EP disclosed
EP-0039892-A1 Substituted phenyl ethers CIBA-GEIGY AG (CH) 1981-11-18 EP disclosed
EP-0030030-A1 Derivatives of 2-aminoethanol, processes for their preparation, pharmaceutical compositions containing such compounds and the use the latter CIBA-GEIGY AG (CH) 1981-06-10 EP disclosed
EP-0015505-A1 3-Amino-1,2-propane diols, process for their preparation, pharmaceutical compositions containing them and use thereof CIBA-GEIGY AG (CH) 1980-09-17 EP disclosed
EP-0005848-A1 N-Alkylated aminoalcohols and their salts, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1979-12-12 EP disclosed