SCHEMBL23578095

SCHEMBL23578095

CCOC(=O)c1cc2c(cc1NC(=O)OC(C)(C)C)n(C)c(=O)c(=O)n2C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.43
▸ TP53 P04637 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ KDM4E B2RXH2 5/20 0.42
▸ HPGD P15428 5/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ GAA P10253 3/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ GALR2 O43603 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ XBP1 P17861 1/20 0.41
▸ CCR6 P51684 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TSHR P16473 2/20 0.40

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
SCHEMBL30034889 1.00 ALDH1A1 (0.43) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL23590999 0.89 SMN1; SMN2 (0.40) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL30036541 0.87 KMT2A (0.38) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL23577722 0.87 KMT2A (0.38) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL30184079 0.85 LMNA (0.43) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL23577752 0.85 LMNA (0.43) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL30035750 0.84 MAPT (0.36) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL23577856 0.84 MAPT (0.36) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL23590998 0.81 ATR (0.42) ALDH1A1TP53MAPTKDM4EHPGD
SCHEMBL30183812 0.81 ATR (0.42) ALDH1A1TP53MAPTKDM4EHPGD

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
CN-115605476-B Substituted tricyclic compounds 鲁宾有限公司 2024-05-24 — — CN disclosed
CN-115605476-A Substituted tricyclic compounds 鲁宾有限公司(IN) 2023-01-13 — — CN disclosed
WO-2021130731-A1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LIMITED (IN) 2021-07-01 — — WO disclosed
WO-2021130731-A1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LIMITED (IN) 2021-07-01 — — WO disclosed
Send feedback