SCHEMBL10568256

SCHEMBL10568256

CC(C)(C=O)C(O)(COc1ccc(-c2ccccc2)cc1)Cn1cncn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
LMNA P02545 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.48
ALDH1A1 P00352 4/20 0.48
TP53 P04637 3/20 0.48
HSP90AA1 P07900 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.40
CYP19A1 P11511 1/20 0.38

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
SCHEMBL10408611 0.90 MAPT (0.53) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10545905 0.89 MAPT (0.58) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10366604 0.87 ALDH1A1 (0.55) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10628712 0.84 MAPT (0.53) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10515326 0.82 MAPT (0.51) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10361043 0.81 HSP90AA1 (0.52) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10851596 0.81 MAPT (0.60) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10830390 0.81 MAPT (0.49) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL10808470 0.78 MAPT (0.56) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL4097760 0.78 MAPT (0.52) MAPTLMNAMEN1KMT2AKDM4E

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
US-4843088-A FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-06-27 US claimed