SCHEMBL8697941

SCHEMBL8697941

N#Cc1ccc(C(F)c2cncnc2)c(F)c1-c1ccc(-c2ccccc2)o1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.34
CYP11B2 P19099 3/20 0.34
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
KDR P35968 1/20 0.33
IMPDH2 P12268 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPKAPK2 P49137 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
SCHEMBL8697485 0.88 CYP11B1 (0.34) CYP11B1CYP11B2FLT1FLT4KDR
SCHEMBL8698606 0.85 ATM (0.32)
SCHEMBL8704175 0.81 CYP2A6 (0.34) CYP11B1CYP11B2
SCHEMBL8698524 0.78 FLT1 (0.33) CYP11B1CYP11B2FLT1FLT4KDR
SCHEMBL8702189 0.74 ATM (0.36) KDM4EMEN1KMT2AMAPKAPK2
SCHEMBL8698118 0.73 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL8697482 0.69 CYP19A1 (0.33) CYP11B1CYP11B2KDM4E
SCHEMBL8700262 0.67 CYP19A1 (0.42) CYP11B1CYP11B2FLT1FLT4KDR
SCHEMBL8698099 0.61 KCNA5 (0.36) CYP11B1CYP11B2
SCHEMBL76097 0.57 CYP2E1 (0.58) MEN1LMNAKMT2A

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