SCHEMBL11359159

SCHEMBL11359159

COC(=O)CC[C@H](N)C(=O)Nc1ccc(C(N)=O)cn1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 2/20 0.49
▸ EPHX2 P34913 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ FGFR3 P22607 1/20 0.38
▸ HCAR3 P49019 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ HDAC1 Q13547 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
SCHEMBL11341223 0.90 EPHX2 (0.47) NNMTEPHX2MAPK1L3MBTL1IDO1
SCHEMBL11351151 0.87 NNMT (0.43) NNMTEPHX2HCAR3MAPK1L3MBTL1
SCHEMBL11364407 0.86 NNMT (0.49) NNMTEPHX2HCAR3HDAC1
SCHEMBL11364463 0.86 NNMT (0.49) NNMTEPHX2HCAR3HDAC1
SCHEMBL5040612 0.78 LNPEP (0.51) EPHX2ALDH1A1LMNAHCAR3MAPK1
SCHEMBL3466195 0.76 NNMT (0.63) NNMTEPHX2ALDH1A1LMNAHCAR3
SCHEMBL838587 0.71 RAB9A (0.51) L3MBTL1
SCHEMBL3465475 0.71 NNMT (0.69) NNMTEPHX2HCAR3
SCHEMBL19151094 0.70 NNMT (0.63) NNMTEPHX2HCAR3MAPK1
SCHEMBL19116338 0.70 NNMT (0.58) NNMTEPHX2HCAR3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10568913-B2 Method for generating mature β-like cells HEALTHREGEN PTY LTD (AU) 2020-02-25 — — US disclosed
US-20160045554-A1 METHOD FOR GENERATING MATURE BETA-LIKE CELLS THE UNIVERSITY OF WESTERN AUSTRALIA (AU) 2016-02-18 — — US disclosed
WO-2014153620-A1 METHOD FOR GENERATING MATURE β-LIKE CELLS THE UNIVERSITY OF WESTERN AUSTRALIA (AU) 2014-10-02 — — WO disclosed
US-4258052-A APPLYING TOPICALLY YU RUEY J 1981-03-24 — — US disclosed
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