SCHEMBL905084

SCHEMBL905084

Cc1ccc(N(c2ccccc2)c2cc(Br)cc(N(c3ccccc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.37
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
PTPRC P08575 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
SCHEMBL905062 0.94 PDK2 (0.35) PDK2ESR1ESR2
SCHEMBL905015 0.93 PDK2 (0.38) PDK2
SCHEMBL12061273 0.93 PDK2 (0.38) PDK2
SCHEMBL18090331 0.91 PDK2 (0.38) PDK2
SCHEMBL12249764 0.91 PDK2 (0.43) PDK2ESR1ESR2PTPRC
SCHEMBL12292340 0.91 PDK2 (0.43) PDK2ESR1ESR2PTPRC
SCHEMBL15618076 0.91 PDK2 (0.43) PDK2ESR1ESR2PTPRC
SCHEMBL12325035 0.91 PDK2 (0.43) PDK2ESR1ESR2PTPRC
SCHEMBL12469759 0.89 PDK2 (0.36) PDK2
SCHEMBL10053406 0.89 PDK2 (0.36) PDK2

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-2012043996-A2 COMPOUND IN WHICH AMINE DERIVATIVE IS SUBSTITUTED WITH FLUORENE, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL THEREOF 덕산하이메탈(주) (KR) 2012-04-05 WO disclosed
WO-2012043996-A2 COMPOUND IN WHICH AMINE DERIVATIVE IS SUBSTITUTED WITH FLUORENE, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL THEREOF 덕산하이메탈(주) (KR) 2012-04-05 WO disclosed