SCHEMBL31345023

SCHEMBL31345023

CCOP(=O)(CC(=O)Nc1c(C)cccc1C)OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ MAPT P10636 3/20 0.51
▸ SCN3A Q9NY46 3/20 0.51
▸ LMNA P02545 3/20 0.51
▸ CYP1A2 P05177 2/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ SCN1A P35498 2/20 0.51
▸ SCN2A Q99250 2/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ MC4R P32245 1/20 0.51
▸ SCN4A P35499 1/20 0.51
▸ MC3R P41968 1/20 0.51
▸ HTR3A P46098 1/20 0.51
▸ SCN5A Q14524 1/20 0.51
▸ SCN9A Q15858 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ BLM P54132 2/20 0.50

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
SCHEMBL4817806 0.84 HPGD (0.53) MAPTLMNAALDH1A1MAPK1HDAC3
SCHEMBL10952765 0.78 NPSR1 (0.53) MAPTSCN3ACYP1A2SCN1ASCN2A
SCHEMBL12497355 0.78 KDM4E (0.47) KMT2AMAPTALDH1A1MAPK1GAA
SCHEMBL13653517 0.75 GAA (0.51) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL10567645 0.75 MAPT (0.66) MEN1KMT2AMAPTSCN3ALMNA
SCHEMBL6887530 0.74 NLRP3 (0.67) MEN1KMT2AMAPTSCN3ALMNA
SCHEMBL2406730 0.74 KMT2A (0.65) MEN1KMT2AMAPTLMNACYP1A2
SCHEMBL13966687 0.74 NPC1 (0.53) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL3447255 0.73 LMNA (0.50) MEN1KMT2ALMNAGAAPOLB
SCHEMBL5598097 0.73 MEN1 (0.54) MEN1KMT2AMAPTLMNAALDH1A1

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-2025043316-A1 PROCESS FOR OBTAINING ANTI-INFLAMMATORY COMPOUNDS, SAID COMPOUNDS, PHARMACEUTICAL COMPOSITION AND USE OF SAID COMPOUNDS AND OF THE PHARMACEUTICAL COMPOSITION UNIVERSIDADE ESTADUAL DE CAMPINAS (BR) 2025-03-06 — — WO disclosed
Send feedback