SCHEMBL7438944

SCHEMBL7438944

CC(C)(C)OC(=O)N1CCC(C=CC(=O)N2Cc3ccccc3C(C(=O)O)C2)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.45
GPR119 Q8TDV5 2/20 0.44
MAPK1 P28482 1/20 0.41
PRMT5 O14744 3/20 0.41
WDR77 Q9BQA1 3/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
STS P08842 1/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
USP30 Q70CQ3 1/20 0.39

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
SCHEMBL7438933 1.00 NAMPT (0.45) NAMPTGPR119MAPK1PRMT5WDR77
SCHEMBL7450160 0.91 NAMPT (0.46) NAMPTGPR119MAPK1PRMT5WDR77
SCHEMBL7450170 0.91 NAMPT (0.46) NAMPTGPR119MAPK1PRMT5WDR77
SCHEMBL30771260 0.83 NAMPT (0.52) NAMPTGPR119MAPK1PRMT5WDR77
SCHEMBL3703899 0.83 NAMPT (0.52) NAMPTGPR119MAPK1PRMT5WDR77
SCHEMBL1791197 0.77 GPR119 (0.46) NAMPTGPR119MAPK1PRMT5WDR77
SCHEMBL4237414 0.74 KDM4E (0.56) GPR119KDM4EPKMMEN1KMT2A
SCHEMBL4237418 0.74 KDM4E (0.56) GPR119KDM4EPKMMEN1KMT2A
SCHEMBL20015682 0.74 GPR119 (0.57) GPR119KDM4EPKMMEN1KMT2A
SCHEMBL20015272 0.74 GPR119 (0.57) GPR119KDM4EPKMMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6384028-B1 TREATMENT OF CARDIOVASCULAR DISORDERS, ANTICOAGULANTS AND VALVE REPLACEMENT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-07 US disclosed
EP-0869944-A1 N-ACYLPIPERIDINYLCARBONYLAMINOCARBOXYLIC ACIDS AND THEIR USE AS GLYCOPROTEIN IIB/IIa ANTAGONISTS AND FIBRINOGEN-BLOOD PLATELETS BINDING INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-10-14 EP disclosed
WO-1996029309-A1 N-ACYLPIPERIDINYLCARBONYLAMINOCARBOXYLIC ACIDS AND THEIR USE AS GLYCOPROTEIN IIB/IIa ANTAGONISTS AND FIBRINOGEN-BLOOD PLATELETS BINDING INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-09-26 WO disclosed