SCHEMBL8037871

SCHEMBL8037871

O=CC1CCN(NC(=O)OCc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
GAA P10253 1/20 0.47
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CTSK P43235 1/20 0.46
LIPE Q05469 1/20 0.46
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
PREP P48147 2/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL9523945 0.85 ALDH1A1 (0.50) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL3673656 0.84 ALDH1A1 (0.49) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL7138245 0.83 ALDH1A1 (0.48) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL2553604 0.80 HTT (0.53) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL3864756 0.80 HTT (0.53) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL9381194 0.80 CTSL (0.53) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL148455 0.80 SMN1; SMN2 (0.70) SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL27518811 0.80 TSHR (0.46) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL2558255 0.78 ALDH1A1 (0.71) ALDH1A1GAACTSLCTSBCTSK
SCHEMBL2558257 0.78 ALDH1A1 (0.71) ALDH1A1GAACTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6123964-A N-(1(R)-((1,2-DIHYDRO-1-METHANESULFONYLSPIRO(3H-INDOLE-3,4' -PIPERDIN)-1'-YL)CARBONYL)-2-(PHENYLMETHYLOXY)ETHYL)-2-AMINO-2-METHYL -PROPANAMIDE, SPECIFIED BINDER/DILUENT, FIRST AND SECOND DILUENTS, DISINTEGRANT, AND LUBRICANT(S); TABLETS MERCK & CO., INC. (US) 2000-09-26 US disclosed
EP-1019402-A1 POLYMORPHIC FORMS OF A GROWTH HORMONE SECRETAGOGUE Merck & Co., Inc. (US) 2000-07-19 EP disclosed
US-6046333-A Convergent process for the preparation of a growth hormone secretagogue MERCK & CO., INC. (US) 2000-04-04 US disclosed
US-6028196-A USING INEXPENSIVE AND ENVIRONMENTALLY ACCEPTABLE STARTING MATERIALS REAGENTS AND SOLVENTS, NO CHROMATOGRAPHIC PURIFICATION OF INTERMEDIATE SPIROINDOLINE SULFONAMIDE TO PRODUCE THE STIMULANTS FOR RELEASING SOMATOTROPIN MERCK & CO., INC. (US) 2000-02-22 US disclosed
EP-0857020-A4 WET GRANULATION FORMULATION OF A GROWTH HORMONE SECRETAGOGUE MERCK & CO INC (US) 1999-01-07 EP disclosed
EP-0863900-A1 PROCESS FOR THE PREPARATION OF A GROWTH HORMONE SECRETAGOGUE Merck & Co., Inc. (US) 1998-09-16 EP disclosed
EP-0823904-A4 PROCESS FOR THE PREPARATION OF SPIROINDOLINES MERCK & CO INC (US) 1998-09-09 EP disclosed
EP-0857020-A1 WET GRANULATION FORMULATION OF A GROWTH HORMONE SECRETAGOGUE Merck & Co., Inc. (US) 1998-08-12 EP disclosed
US-5767124-A ADMINISTERING TO HUMANS AND ANIMALS TO TREAT PHYSIOLOGICAL OR MEDICAL CONDITIONS CHARACTERIZED BY A DEFICIENCY IN GROWTH HORMONE SECRETION MERCK & CO., INC. (US) 1998-06-16 US disclosed
WO-1998018815-A1 CONVERGENT PROCESS FOR THE PREPARATION OF A GROWTH HORMONE SECRETAGOGUE MERCK & CO., INC. (US) 1998-05-07 WO disclosed
US-5723616-A Process for the preparation of a growth hormone secretagogue MERCK & CO., INC. (US) 1998-03-03 US disclosed
EP-0823904-A1 PROCESS FOR THE PREPARATION OF SPIROINDOLINES Merck & Co., Inc. (US) 1998-02-18 EP disclosed
WO-1997015191-A1 WET GRANULATION FORMULATION OF A GROWTH HORMONE SECRETAGOGUE MERCK & CO., INC. (US) 1997-05-01 WO disclosed
WO-1997015574-A1 POLYMORPHIC FORMS OF A GROWTH HORMONE SECRETAGOGUE MERCK & CO., INC. (US) 1997-05-01 WO disclosed
WO-1997015573-A1 PROCESS FOR THE PREPARATION OF A GROWTH HORMONE SECRETAGOGUE MERCK & CO., INC. (US) 1997-05-01 WO disclosed
WO-1996033189-A1 PROCESS FOR THE PREPARATION OF SPIROINDOLINES MERCK & CO., INC. (US) 1996-10-24 WO disclosed