SCHEMBL20828558

SCHEMBL20828558

CC1(C)c2ccccc2-c2ccc(-c3c(-c4ccc5oc6ccccc6c5c4-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc6oc7ccccc7c6c5)cc4)ccc4oc5ccccc5c34)cc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
MAPT P10636 1/20 0.31
ALK Q9UM73 1/20 0.30
PDK2 Q15119 1/20 0.30
WEE1 P30291 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
SCHEMBL20828702 0.96 MAPT (0.31) MAPTALKPDK2WEE1
SCHEMBL20828573 0.95 MEN1 (0.34) MAPT
SCHEMBL20828567 0.94 MAPT (0.31) MAPTALKPDK2WEE1
SCHEMBL20828709 0.94 MAPT (0.32) MAPTALKPDK2WEE1
SCHEMBL20828602 0.94 MAPT (0.32) MAPTALKPDK2WEE1
SCHEMBL20828601 0.94 MAPT (0.32) MAPTALKPDK2WEE1
SCHEMBL20828594 0.93
SCHEMBL20828572 0.91 ALK (0.32) MAPTALKWEE1
SCHEMBL17126372 0.91 PDK2 (0.36) HSP90AA1HSP90AB1MAPTALKPDK2
SCHEMBL20828563 0.90 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