SCHEMBL29206645

SCHEMBL29206645

CC1C(c2nnco2)CN1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 3/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ TSHR P16473 6/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ LMNA P02545 4/20 0.35
▸ HSD11B1 P28845 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ HTT P42858 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAP4K4 O95819 1/20 0.32

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
SCHEMBL30164912 1.00 GPR119 (0.39) GPR119ALDH1A1TSHRKMT2AMEN1
SCHEMBL24824547 1.00 GPR119 (0.39) GPR119ALDH1A1TSHRKMT2AMEN1
SCHEMBL24824546 0.77 GPR119 (0.45) GPR119ALDH1A1MAPTUSP2SMN1; SMN2
SCHEMBL12234858 0.77 ALDH1A1 (0.60) ALDH1A1TSHRKMT2AMEN1L3MBTL1
SCHEMBL9965941 0.75 GPR119 (0.43) GPR119USP2SMN1; SMN2
SCHEMBL16187765 0.75 GPR119 (0.43) GPR119USP2SMN1; SMN2
SCHEMBL10189711 0.75 GPR119 (0.43) GPR119USP2SMN1; SMN2
SCHEMBL30164891 0.74 PIK3CD (0.36) GPR119ALDH1A1KMT2AMEN1
SCHEMBL29206642 0.74 PIK3CD (0.36) GPR119ALDH1A1KMT2AMEN1
SCHEMBL15024201 0.73 GPR119 (0.53) GPR119MAPTUSP2SMN1; SMN2

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
CN-117858872-A Heterocyclic EGFR inhibitors for the treatment of cancer 缆图药品公司 2024-04-09 — — CN disclosed
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