SCHEMBL623223

SCHEMBL623223

CCCN(CO)C(=O)C1CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
PKM P14618 1/20 0.42
BCHE P06276 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CA12 O43570 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
TSHR P16473 2/20 0.38
MAPK1 P28482 1/20 0.38
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CNR2 P34972 1/20 0.34
CA1 P00915 1/20 0.33
DPP4 P27487 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
SCHEMBL2960396 0.89 BCHE (0.49) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL11980194 0.86 BCHE (0.44) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL20928014 0.86 BCHE (0.44) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL2953586 0.85 ALDH1A1 (0.44) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL17208378 0.84 ALDH1A1 (0.41) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL17208375 0.84 ALDH1A1 (0.41) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL19380754 0.81 BCHE (0.54) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL13676231 0.79 BCHE (0.53) ALDH1A1PKMBCHEL3MBTL1CA12
SCHEMBL2959000 0.79 BCHE (0.56) ALDH1A1PKMBCHEL3MBTL1MEN1
SCHEMBL15254560 0.77 L3MBTL1 (0.50) ALDH1A1BCHEL3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2603098-A2 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER Senomyx, Inc. (US) 2013-06-19 EP disclosed
WO-2012021837-A2 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER SENOMYX, INC. (US) 2012-02-16 WO disclosed