SCHEMBL6159635

SCHEMBL6159635

O=[N+]([O-])c1ccccc1NC1CCN(Cc2ccccc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 1.00
MAPT P10636 3/20 0.77
PKM P14618 1/20 0.77
RAB9A P51151 1/20 0.77
NPSR1 Q6W5P4 1/20 0.71
KMT2A Q03164 2/20 0.65
MEN1 O00255 1/20 0.65
ALDH1A1 P00352 2/20 0.64
HTT P42858 1/20 0.64
SIGMAR1 Q99720 5/20 0.63
KDM4E B2RXH2 1/20 0.62
GAA P10253 1/20 0.62
LMNA P02545 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
BCHE P06276 2/20 0.58
ACHE P22303 2/20 0.58
BACE1 P56817 2/20 0.58
ROCK2 O75116 1/20 0.52
ROCK1 Q13464 1/20 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 SCHEMBL11102389 0.99 MAPK1 (0.97) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL7014000 0.90 MAPK1 (0.82) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL8884292 0.87 MAPK1 (0.77) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL6161561 0.87 MAPK1 (0.80) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL4069632 0.86 MEN1 (0.76) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL4138824 0.86 MAPK1 (0.75) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL6585695 0.86 MAPK1 (0.78) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL3288703 0.86 MAPK1 (0.78) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL22588060 0.84 MAPK1 (0.73) MAPK1MAPTPKMRAB9ANPSR1
SCHEMBL3604839 0.83 MAPK1 (0.74) MAPK1MAPTPKMRAB9ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
EP-0990653-B1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-09-15 EP disclosed
WO-2002100861-A1 1-(3-PHENYLOXYPROPYL)PIPERIDINE DERIVATIVES AKZO NOBEL N.V. (NL) 2002-12-19 WO disclosed
US-6258825-B1 ANALGESIC, A RELIEVER AGAINST TOLERANCE TO A NARCOTIC ANALGESIC REPRESENTED BY MORPHINE, REMEDY FOR PARKINSONISM, A REMEDY FOR CHOREA, AN ANTIDEPRESSANT, A REMEDY FOR DIABETES INSIPIDUS, A REMEDY FOR POLYURIA, OR HYPOTENSION BANYU PHARMACEUTICAL CO., LTD. (JP) 2001-07-10 US disclosed
US-6063796-A HETEROCYCLIC COMPOUNDS OF PIPERIDINE MERCK & CO., INC. (US) 2000-05-16 US disclosed
EP-0984779-A4 SOMATOSTATIN AGONISTS MERCK & CO INC (US) 2000-05-10 EP disclosed
EP-0990653-A1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed
EP-0984779-A1 SOMATOSTATIN AGONISTS Merck & Co., Inc. (US) 2000-03-15 EP disclosed
US-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed
WO-1998044922-A1 SOMATOSTATIN AGONISTS MERCK & CO., INC. (US) 1998-10-15 WO disclosed
EP-0828754-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1998-03-18 EP disclosed
CN-1143647-A Dipeptides which promote release of growth hormone PFIZER (US) 1997-02-26 CN disclosed
WO-1996038471-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1996-12-05 WO disclosed
EP-0029707-B1 NOVEL PIPERIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KYOWA HAKKO KOGYO CO., LTD (JP) 1984-02-01 EP disclosed
US-4410528-A Hypotensive piperidine derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1983-10-18 US disclosed
EP-0029707-A1 Novel piperidine derivatives, method for the preparation thereof and pharmaceutical compositions containing them KYOWA HAKKO KOGYO CO., LTD (JP) 1981-06-03 EP disclosed
US-4031226-A ANTIEMETIC, PSYCHOTROPIC JANSSEN PHARMACEUTICA N.V. (BE) 1977-06-21 US disclosed