SCHEMBL28401265

SCHEMBL28401265

CC(C)OC(=O)C(N)(CC(C)(C)C)c1ccc(-n2cc(F)cn2)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 11/20 0.37
▸ GCG P01275 1/20 0.37
▸ HDAC3 O15379 1/20 0.32
▸ NCOR1 O75376 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NAMPT P43490 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ GLP1R P43220 2/20 0.31
▸ GIPR P48546 2/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ MAPKAPK2 P49137 1/20 0.31

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
SCHEMBL20907564 1.00 GCGR (0.37) GCGRGCGHDAC3NCOR1HDAC1
SCHEMBL21112825 0.84 GCGR (0.38) GCGRGCGHDAC3NCOR1HDAC1
SCHEMBL21112823 0.84 GCGR (0.38) GCGRGCGHDAC3NCOR1HDAC1
SCHEMBL20907613 0.81 SMN1; SMN2 (0.40) MEN1KMT2AALDH1A1
SCHEMBL21149466 0.80 MEN1 (0.35) MEN1KMT2AALDH1A1HPGDPTPN1
SCHEMBL20907804 0.80 MEN1 (0.35) MEN1KMT2AALDH1A1HPGDPTPN1
SCHEMBL21149580 0.79 NPC1 (0.36) MEN1KMT2AALDH1A1HPGDMAOA
SCHEMBL21148969 0.78 RXFP1 (0.37) MEN1KMT2AALDH1A1HPGDPTPN1
SCHEMBL28401742 0.78 RXFP1 (0.37) MEN1KMT2AALDH1A1HPGDPTPN1
SCHEMBL20907878 0.76 PTPN1 (0.41) MEN1KMT2AALDH1A1PTPN1

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
CN-111212832-B 1-Benzyl-2-imino-4-phenyl-5-oxoimidazolidine derivatives as HIV protease inhibitors 吉利德科学公司 2023-09-15 — — CN disclosed
CN-111212832-A 1-benzyl-2-imino-4-phenyl-5-oxoimidazolidine derivatives as HIV protease inhibitors 吉利德科学公司 2020-05-29 — — CN disclosed
Send feedback