Ichthynone

Ichthynone

SCHEMBL29934702

COc1cc2c(cc1-c1coc3c4c(c(OC)cc3c1=O)OC(C)(C)C=C4)OCO2

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.60
CYP3A4 P08684 7/20 0.47
TP53 P04637 5/20 0.47
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MAPK1 P28482 3/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
PDE4D Q08499 2/20 0.45
USP2 O75604 2/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38

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
Ichthynone SCHEMBL9924621 1.00 BCHE (0.60) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL9924624 0.88 BCHE (0.73) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL30500621 0.88 BCHE (0.63) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL30534406 0.87 BCHE (0.79) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL9924622 0.87 BCHE (0.79) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL29367894 0.79 BCHE (0.76) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL29439362 0.75 BCHE (1.00) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL5094581 0.75 BCHE (1.00) BCHECYP3A4TP53MAPTSMN1; SMN2
SCHEMBL4283565 0.73 SMN1; SMN2 (0.51) CYP3A4MAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL16694334 0.67 BCHE (1.00) BCHECYP3A4TP53MAPTSMN1; SMN2

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-113200970-B Osthole isoxazoline derivatives, and preparation method and application thereof 郑州大学 2023-06-13 CN disclosed
US-20230057355-A1 GENE NETWORKS THAT MEDIATE REMYELINATION OF THE HUMAN BRAIN UNIVERSITY OF ROCHESTER 2023-02-23 US disclosed
US-20220291237-A1 Gene Expression Inflammatory Age and Its Uses Edifice Health, Inc. (US) 2022-09-15 US disclosed