SCHEMBL20631967

SCHEMBL20631967

Cc1ccc(OCC(=O)N[C@H]2C[C@@H](NC(=O)COC3(C)CC3)C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ POLB P06746 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ ATF4 P18848 1/20 0.48
▸ PKM P14618 1/20 0.46
▸ HPGD P15428 1/20 0.44

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
SCHEMBL20610459 0.81 ATF4 (0.59) KMT2AMEN1MAPTLMNAATF4
SCHEMBL12629118 0.80 LMNA (0.72) KMT2AMEN1L3MBTL1LMNAATF4
SCHEMBL17658518 0.80 LMNA (0.72) KMT2AMEN1L3MBTL1LMNAATF4
SCHEMBL19538657 0.77 KMT2A (0.72) KMT2AMEN1L3MBTL1LMNAATF4
SCHEMBL3456287 0.76 KMT2A (0.73) KMT2AMEN1L3MBTL1LMNAHPGD
SCHEMBL23383772 0.75 HDAC1 (0.55) KMT2AMEN1POLBMAPTLMNA
SCHEMBL17658585 0.74 ATF4 (0.82) KMT2ALMNAATF4
SCHEMBL17658644 0.74 ATF4 (0.82) KMT2ALMNAATF4
SCHEMBL19134248 0.74 LMNA (0.63) KMT2AMEN1L3MBTL1LMNAATF4
SCHEMBL17658492 0.74 ATF4 (0.86) KMT2AMAPTL3MBTL1LMNAATF4

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
WO-2019008506-A1 N-(3-(2-(4-CHLOROPHENOXY)ACETAMIDO)BICYCLO[1.1.1]PENTAN-1-YL)-2-CYCLOBUTANE-1-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ATF4 INHIBITORS FOR TREATING CANCER AND OTHER DISEASES GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-10 — — WO disclosed
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