SCHEMBL6649581

SCHEMBL6649581

Fc1ccc(-c2ccncc2-c2nc(-c3ccc(Cl)c(Cl)c3)cs2)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 15/20 0.60
RPS6KA3 P51812 1/20 0.54
KDM4E B2RXH2 2/20 0.53
AR P10275 1/20 0.53
CYP19A1 P11511 1/20 0.51
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL6651736 0.86 RAB9A (0.61) EIF4ERPS6KA3KDM4EARCYP19A1
SCHEMBL6646252 0.86 CYP19A1 (0.55) EIF4ERPS6KA3KDM4EARCYP19A1
SCHEMBL6628622 0.84 CYP19A1 (0.59) RPS6KA3KDM4EARCYP19A1MEN1
SCHEMBL6649024 0.81 EIF4E (0.64) EIF4EKDM4ECYP19A1MEN1NPC1
SCHEMBL14797442 0.80 EIF4E (0.69) EIF4EKDM4EMEN1NPC1RAB9A
SCHEMBL6649680 0.79 KDM4E (0.62) RPS6KA3KDM4EARCYP19A1MEN1
SCHEMBL14797397 0.79 EIF4E (0.71) EIF4EKDM4EMEN1NPC1RAB9A
SCHEMBL6649689 0.78 AR (0.57) EIF4ERPS6KA3KDM4EARCYP19A1
SCHEMBL6648675 0.78 EIF4E (0.58) EIF4EKDM4EMEN1NPC1RAB9A
SCHEMBL6648869 0.78 EIF4E (0.55) EIF4EKDM4EMEN1NPC1RAB9A

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
EP-1432706-A2 3-PYRIDYL OR 4-ISOQUINOLINYL THIAZOLES AS C17,20 LYASE INHIBITORS Bayer Pharmaceuticals Corporation (US) 2004-06-30 EP disclosed
WO-2003027085-A2 3-PYRIDYL OR 4-ISOQUINOLINYL THIAZOLES AS C17,20 LYASE INHIBITORS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 WO disclosed