SCHEMBL24728149

SCHEMBL24728149

CC1(C)C=Cc2c(ccc3cc(C(=O)/C=C/c4ccccc4NC(F)(F)F)oc23)O1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.38
ODC1 P11926 2/20 0.38
ACHE P22303 2/20 0.38
BCHE P06276 1/20 0.38
BACE1 P56817 1/20 0.38
HIF1AN Q9NWT6 1/20 0.38
PDE4D Q08499 2/20 0.37
ALPL P05186 1/20 0.34
ALPI P09923 1/20 0.34
ALPG P10696 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL24728150 0.84 RAB9A (0.41) PTPN1ODC1ACHEBCHEBACE1
SCHEMBL24728221 0.81 HIF1AN (0.50) ODC1ACHEBCHEHIF1ANPDE4D
SCHEMBL29823031 0.81 HIF1AN (0.50) ODC1ACHEBCHEHIF1ANPDE4D
SCHEMBL24728166 0.81 PTPN1 (0.52) PTPN1ODC1ACHEBCHEBACE1
SCHEMBL24728283 0.78 PTPN1 (0.41) PTPN1ODC1ACHEBCHEBACE1
SCHEMBL29822826 0.77 HIF1AN (0.51) ODC1ACHEBCHEHIF1ANPDE4D
SCHEMBL24728303 0.77 HIF1AN (0.51) ODC1ACHEBCHEHIF1ANPDE4D
SCHEMBL24728230 0.76 MAPT (0.45) PTPN1ODC1ACHEBCHEBACE1
SCHEMBL24728235 0.76 PTPN1 (0.40) PTPN1ODC1ACHEBCHEBACE1
SCHEMBL29822730 0.76 PTPN1 (0.40) PTPN1ODC1ACHEBCHEBACE1

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-2022158624-A1 NOVEL BENZOPYRAN DERIVATIVE COMPOUND, PREPARATION METHOD THEREFOR, AND ANTICANCER COMPOSITION COMPRISING SAME 연세대학교 산학협력단 2022-07-28 WO disclosed