SCHEMBL22916735

SCHEMBL22916735

CC1(C)c2ccccc2-c2ccc(-c3c4ccc(-c5ccc6oc7ccccc7c6c5)cc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc(-c5ccc6oc7ccccc7c6c5)cc34)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
MEN1 O00255 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PGR P06401 1/20 0.35
CASP3 P42574 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
MAOA P21397 1/20 0.34
AHR P35869 2/20 0.33
ALK Q9UM73 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PLA2G2A P14555 2/20 0.33

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
SCHEMBL13488110 1.00 HSP90AA1 (0.38) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL12577907 1.00 HSP90AA1 (0.38) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL22916821 1.00 HSP90AA1 (0.38) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL24877883 0.97 HSP90AA1 (0.40) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL13487738 0.96 MEN1 (0.37) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL13487887 0.96 PLA2G2A (0.38) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL18272691 0.96 HSP90AA1 (0.40) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL17945649 0.94 HSP90AA1 (0.39) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL13488036 0.93 CASP3 (0.35) HSP90AA1HSP90AB1MEN1MAPTKMT2A
SCHEMBL13487344 0.93 HSP90AA1 (0.35) HSP90AA1HSP90AB1MEN1MAPTKMT2A

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
US-20210336149-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2021-10-28 US disclosed
US-20210028365-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPLIANCE IDEMITSU KOSAN CO.,LTD. (JP) 2021-01-28 US disclosed