SCHEMBL17209154

SCHEMBL17209154

CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-n3c4ccc(Br)cc4c4cc(Br)ccc43)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ NLRP3 Q96P20 1/20 0.32
▸ PGR P06401 2/20 0.32
▸ TDP2 O95551 1/20 0.32
▸ MDM2 Q00987 1/20 0.31
▸ DNMT1 P26358 1/20 0.31
▸ HDAC4 P56524 1/20 0.31
▸ DCLK1 O15075 1/20 0.30
▸ PRKD3 O94806 1/20 0.30
▸ MAP4K4 O95819 1/20 0.30
▸ CHEK2 O96017 1/20 0.30
▸ CSF1R P07333 1/20 0.30
▸ FER P16591 1/20 0.30
▸ CDK2 P24941 1/20 0.30
▸ MARK3 P27448 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
SCHEMBL30860151 0.94 PDK2 (0.34) PDK2ALDH1A1MAPK1PDE4BPGR
SCHEMBL28664747 0.94 PDK2 (0.34) PDK2ALDH1A1MAPK1PDE4BPGR
SCHEMBL12647531 0.92 PDK2 (0.32) PDK2ALDH1A1MAPK1PDE4BNPC1
SCHEMBL17742388 0.92 TSPO (0.36) PDK2ALDH1A1MAPK1PDE4BTDP2
SCHEMBL17209139 0.91 PDK2 (0.38) PDK2NPC1RAB9APGRTDP2
SCHEMBL17209282 0.91 PDK2 (0.38) PDK2NPC1RAB9APGRTDP2
SCHEMBL17209171 0.91 PDK2 (0.38) PDK2NPC1RAB9APGRTDP2
SCHEMBL17209209 0.91 PDK2 (0.38) PDK2NPC1RAB9APGRTDP2
SCHEMBL17209134 0.91 PDK2 (0.38) PDK2NPC1RAB9APGRTDP2
SCHEMBL17209153 0.91 PDK2 (0.38) PDK2NPC1RAB9APGRTDP2

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-2016043394-A1 LIGHT EMITTING DIODE AND ELECTRONIC DEVICE COMPRISING SAME 주식회사 엘엠에스 2016-03-24 — — WO disclosed
WO-2015163584-A1 NOVEL COMPOUND AND LIGHT EMITTING ELEMENT COMPRISING SAME 주식회사 엘엠에스 2015-10-29 — — WO disclosed
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