SCHEMBL8698118

SCHEMBL8698118

OC(c1cncnc1)c1ccc(F)c(-c2ccc(-c3ccccc3)o2)c1F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
HPGD P15428 1/20 0.32
ATM Q13315 1/20 0.31
HDAC4 P56524 2/20 0.31
NQO2 P16083 1/20 0.31
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
PDE4B Q07343 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8698606 0.87 ATM (0.32) ATM
SCHEMBL8697485 0.85 CYP11B1 (0.34) CYP11B1CYP11B2
SCHEMBL8698099 0.77 KCNA5 (0.36) CYP11B1CYP11B2HPGDATMNQO2
SCHEMBL8698524 0.75 FLT1 (0.33) CYP11B1CYP11B2SMN1; SMN2
SCHEMBL8697941 0.73 CYP11B1 (0.34) CYP11B1CYP11B2
SCHEMBL8702189 0.67 ATM (0.36) HPGDATMNQO2CCNCCDK8
SCHEMBL8697482 0.66 CYP19A1 (0.33) CYP11B1CYP11B2
SCHEMBL11136545 0.66 ATM (0.44) CYP11B1CYP11B2HPGDATMHDAC4
SCHEMBL8700262 0.64 CYP19A1 (0.42) CYP11B1CYP11B2
SCHEMBL11138769 0.64 ATM (0.54) CYP11B1CYP11B2HPGDATMHDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998018791-A1 HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1998-05-07 WO claimed
WO-1998018791-A1 HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1998-05-07 WO disclosed