SCHEMBL7568469

SCHEMBL7568469

CC(=O)N1Cc2ccccc2C2(CCNCC2)C1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.50
DPP9 Q86TI2 1/20 0.49
DPP7 Q9UHL4 1/20 0.49
NAMPT P43490 4/20 0.39
HSD11B1 P28845 3/20 0.39
DPP4 P27487 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
P2RY1 P47900 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRL1 P41146 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL22765655 0.90 NOTUM (0.58) NOTUMHSD11B1HDAC1HDAC6ALDH1A1
SCHEMBL653997 0.87 DPP9 (0.50) NOTUMDPP9DPP7NAMPTHSD11B1
SCHEMBL11939412 0.84 KCNH2 (0.41) NOTUMDPP9DPP7HSD11B1OPRM1
SCHEMBL652952 0.82 MAPK1 (0.52) DPP9DPP7NAMPTHDAC1HDAC6
SCHEMBL1747817 0.82 NOTUM (0.49) NOTUMHSD11B1HDAC1HDAC6ALDH1A1
SCHEMBL11939430 0.82 SIGMAR1 (0.48) NAMPTOPRM1OPRL1KCNH2
SCHEMBL5578840 0.81 DPP9 (0.44) DPP9DPP7NAMPTHSD11B1ALDH1A1
SCHEMBL12934775 0.79 OPRM1 (0.46) NOTUMHSD11B1HDAC1HDAC6OPRM1
SCHEMBL12935088 0.78 SLC18A3 (0.46) NOTUMHSD11B1ALDH1A1MAPK1OPRM1
SCHEMBL5580211 0.78 AVPR1A (0.43) DPP9DPP7ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1817036-B1 MODULATORS OF MUSCARINIC RECEPTORS VERTEX PHARMA (US) 2012-07-04 EP disclosed
US-7863449-B2 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-04 US disclosed
US-7863449-B2 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-04 US disclosed
US-5652235-A Method of using spiro piperidines to promote the release of growth hormone MERCK & CO., INC. (US) 1997-07-29 US disclosed
US-5536716-A Spiro piperidines and homologs which promote release of growth hormone MERCK & CO., INC. (US) 1996-07-16 US disclosed
EP-0615977-A1 Spiro piperidines and homologs which promote release of growth hormone MERCK & CO. INC. (US) 1994-09-21 EP disclosed
WO-1994013696-A1 SPIRO PIPERIDINES AND HOMOLOGS WHICH PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-06-23 WO disclosed