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SCHEMBL20828702

SCHEMBL20828702

CC1(C)c2ccccc2-c2ccc(-c3c(-c4ccc5oc6ccccc6c5c4-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)ccc4oc5ccccc5c34)cc21

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.31
▸ ALK Q9UM73 2/20 0.31
▸ PDK2 Q15119 1/20 0.31
▸ WEE1 P30291 1/20 0.31
▸ PLA2G2A P14555 1/20 0.30
▸ PLA2G4A P47712 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL20828602 0.98 MAPT (0.32) MAPTALKPDK2WEE1PLA2G2A
SCHEMBL20828709 0.98 MAPT (0.32) MAPTALKPDK2WEE1PLA2G2A
SCHEMBL20828601 0.98 MAPT (0.32) MAPTALKPDK2WEE1PLA2G2A
SCHEMBL20828594 0.96 — —
SCHEMBL20828567 0.96 MAPT (0.31) MAPTALKPDK2WEE1
SCHEMBL20828558 0.96 HSP90AA1 (0.31) MAPTALKPDK2WEE1
SCHEMBL20828573 0.95 MEN1 (0.34) MAPTMEN1THRBRECQLBLM
SCHEMBL20828572 0.93 ALK (0.32) MAPTALKWEE1PLA2G2APLA2G4A
SCHEMBL20828666 0.92 MAPT (0.31) MAPTALKWEE1
SCHEMBL20828563 0.92 ALK (0.31) MAPTALKPDK2WEE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019054599-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME (주)피엔에이치테크 2019-03-21 — — WO disclosed