SCHEMBL19293191

SCHEMBL19293191

CC1(C)c2ccccc2-c2ccc(C3=CC(c4ccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc4)NC(c4ccccc4)N3)cc21

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.31
▸ PLA2G4A P47712 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31

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
SCHEMBL19293193 1.00 PLA2G2A (0.31) PLA2G2APLA2G4AHSP90AA1HSP90AB1
SCHEMBL19293237 0.84 PLA2G2A (0.38) PLA2G2APLA2G4A
SCHEMBL20654880 0.81 PLA2G2A (0.30) PLA2G2APLA2G4A
SCHEMBL15866330 0.80 — —
SCHEMBL18086158 0.79 HSP90AA1 (0.43) PLA2G2APLA2G4AHSP90AA1HSP90AB1
SCHEMBL16017880 0.79 HSP90AA1 (0.43) PLA2G2APLA2G4AHSP90AA1HSP90AB1
SCHEMBL15866368 0.78 PLA2G2A (0.33) PLA2G2APLA2G4A
SCHEMBL20277263 0.77 PLA2G2A (0.46) PLA2G2APLA2G4AHSP90AA1HSP90AB1
SCHEMBL13443626 0.77 MAPT (0.44) PLA2G2APLA2G4AHSP90AA1HSP90AB1
SCHEMBL27358837 0.77 — —

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
EP-3211682-A1 AROMATIC HETEROCYCLIC DERIVATIVE, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL AND ORGANIC ELECTROLUMINESCENCE DEVICE FIELD Idemitsu Kosan Co., Ltd (JP) 2017-08-30 — — EP disclosed
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