SCHEMBL7203924

SCHEMBL7203924

CC(C)(C)OC(=O)C(N)c1ccccc1N

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.39
ALDH1A1 P00352 5/20 0.37
HSD17B10 Q99714 3/20 0.37
CFTR P13569 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
LTA4H P09960 1/20 0.35
GRM6 O15303 1/20 0.35
SLC7A5 Q01650 1/20 0.34
KYNU Q16719 2/20 0.33
ADRA2B P18089 1/20 0.33
PTGS1 P23219 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33
BCHE P06276 1/20 0.33

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
SCHEMBL3414451 0.85 LMNA (0.43) AAK1ALDH1A1HSD17B10CFTRLMNA
SCHEMBL1427758 0.83 ALDH1A1 (0.37) AAK1ALDH1A1HSD17B10CFTRLMNA
SCHEMBL29168896 0.83 GABRA1 (0.41) AAK1ALDH1A1LMNAKMT2ALTA4H
SCHEMBL16410353 0.83 APP (0.37) AAK1ALDH1A1HSD17B10CFTRLMNA
SCHEMBL283454 0.83 CA12 (0.37) AAK1LMNAKMT2ALTA4HGRM6
SCHEMBL5323694 0.82 AAK1 (0.35) AAK1LMNAKMT2ALTA4HGRM6
SCHEMBL8568940 0.81 ALDH1A1 (0.47) ALDH1A1HSD17B10CFTRKMT2AADRA2B
SCHEMBL5982890 0.81 LMNA (0.40) AAK1ALDH1A1HSD17B10CFTRLMNA
SCHEMBL30199688 0.81 AAK1 (0.35) AAK1LMNAKMT2ALTA4HSLC7A5
Water SCHEMBL27502853 0.81 AAK1 (0.35) AAK1LMNAKMT2ALTA4HSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0921122-B1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2003-05-21 EP disclosed
EP-0714299-B1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2002-04-24 EP disclosed
US-6110967-A USEFUL AS AGENTS FOR PREVENTING AND TREATING METABOLIC OSTEOPATHY SUCH AS OSTEOPOROSIS, HYPERCALCEMIA AND BONE METASTASIS OF CANCER BECAUSE THEY SPECIFICALLY INHIBITS CATHEPSIN L AND ITS FAMILY ENZYMES TO INHIBIT BONE RESORPTION TAIHO PHARMACEUTICALS CO., LTD. (JP) 2000-08-29 US disclosed
EP-0921122-A1 NOVEL EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1999-06-09 EP disclosed
US-5767118-A 4-Heterocyclic peperidines promote release of growth hormone MERCK & CO., INC. (US) 1998-06-16 US disclosed
US-5760054-A BENIGN PROSTATIC HYPERTROPHY MERCK & CO., INC. (US) 1998-06-02 US disclosed
EP-0785784-A4 4-HETEROCYCLIC PIPERIDINES PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 1998-03-11 EP disclosed
US-5691323-A BENZIMIDAZOL-2-ONES MERCK & CO., INC. (US) 1997-11-25 US disclosed
US-5665719-A Benzoxazinone and benzopyrimidinone piperidinyl tocolytic oxytocin receptor antagonists MERCK & CO., INC. (US) 1997-09-09 US disclosed
EP-0785784-A1 4-HETEROCYCLIC PIPERIDINES PROMOTE RELEASE OF GROWTH HORMONE Merck & Co., Inc. (US) 1997-07-30 EP disclosed
EP-0755392-A4 ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS MERCK & CO INC (US) 1997-05-02 EP disclosed
EP-0755392-A1 ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1997-01-29 EP disclosed
US-5574044-A BENZIMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF MYOPIA MERCK & CO., INC. (US) 1996-11-12 US disclosed
EP-0714299-A4 1996-07-10 EP disclosed
EP-0714299-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1996-06-05 EP disclosed
WO-1996013265-A1 4-HETEROCYCLIC PIPERIDINES PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1996-05-09 WO disclosed
WO-1996013262-A1 MUSCARINE ANTAGONISTS MERCK & CO., INC. (US) 1996-05-09 WO disclosed
WO-1995028397-A1 ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-10-26 WO disclosed
WO-1995002405-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-01-26 WO disclosed