SCHEMBL29050591

SCHEMBL29050591

COCCCOc1cc2c(nc1OC)-c1cc(=O)c(C(=O)OC)cn1[C@H](C(C)C)C2

nearest known ligand 0.85

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2B6 P20813 1/20 0.85
TENT4A Q5XG87 1/20 0.85
TENT4B Q8NDF8 1/20 0.85
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
CRHBP P24387 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHR2 Q13324 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
AXL P30530 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CNR2 P34972 2/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL29070749 1.00 CYP2B6 (0.85) CYP2B6TENT4ATENT4BMEN1ALDH1A1
SCHEMBL21327293 0.93 CYP2B6 (0.83) CYP2B6TENT4ATENT4BMEN1ALDH1A1
SCHEMBL29714618 0.93 CYP2B6 (0.83) CYP2B6TENT4ATENT4BMEN1ALDH1A1
SCHEMBL22952278 0.93 CYP2B6 (0.83) CYP2B6TENT4ATENT4BMEN1ALDH1A1
SCHEMBL30084996 0.93 CYP2B6 (0.83) CYP2B6TENT4ATENT4BMEN1ALDH1A1
SCHEMBL22952841 0.93 CYP2B6 (0.83) CYP2B6TENT4ATENT4B
SCHEMBL21327150 0.93 CYP2B6 (0.88) CYP2B6TENT4ATENT4B
SCHEMBL29714547 0.93 CYP2B6 (0.88) CYP2B6TENT4ATENT4B
SCHEMBL22952848 0.93 CYP2B6 (0.81) CYP2B6TENT4ATENT4B
SCHEMBL30084997 0.93 CYP2B6 (0.81) CYP2B6TENT4ATENT4B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116751200-A Tricyclic compounds containing substituted pyridones and methods of using the same 爱彼特生物制药公司 2023-09-15 CN disclosed
CN-110114071-B Tricyclic compounds containing substituted pyridones and methods of using the same 爱彼特生物制药公司 2023-07-04 CN disclosed
EP-3534903-B1 SUBSTITUTED PYRIDINONE-CONTAINING TRICYCLIC COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORP (CA) 2022-08-03 EP disclosed