SCHEMBL8662136

SCHEMBL8662136

CCCN(CCC(=O)OC)C(CC)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 3/20 0.39
SLC1A1 P43005 1/20 0.38
KDM5A P29375 2/20 0.37
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NOD1 Q9Y239 2/20 0.33
CA12 O43570 4/20 0.33
CA14 Q9ULX7 4/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
FDPS P14324 1/20 0.32
CA2 P00918 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30

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
SCHEMBL7145075 0.95 KMT2A (0.47) MEN1KMT2ATSHRSLC1A1KDM5A
SCHEMBL8816379 0.89 MEN1 (0.42) MEN1KMT2ATSHRSLC1A1KDM5A
SCHEMBL12563524 0.87 MEN1 (0.41) MEN1KMT2ATSHRSLC1A1KDM5A
SCHEMBL8660845 0.87 KMT2A (0.43) MEN1KMT2ATSHRSLC1A1KDM5A
SCHEMBL12563519 0.84 MEN1 (0.41) MEN1KMT2ATSHRSLC1A1KDM5A
SCHEMBL20814001 0.79 KMT2A (0.46) MEN1KMT2ATSHRSLC1A1KDM5A
SCHEMBL12156898 0.76 FDPS (0.39) TSHRSLC1A1CA12CA9FDPS
SCHEMBL20814075 0.73 MEN1 (0.40) MEN1KMT2ATSHRSLC1A1KDM5A
SCHEMBL7140859 0.73 GABRA1 (0.49) HPGDGABRA1GABRG2GABRB3
SCHEMBL7136332 0.73 GABRA1 (0.49) HPGDGABRA1GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756508-A Muscarine antagonists MERCK & CO., INC. (US) 1998-05-26 US disclosed