SCHEMBL23259154

SCHEMBL23259154

Cc1c(C2CC2)cccc(=O)c1OC(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ HTR6 P50406 5/20 0.34
▸ HTR2C P28335 2/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ DDB1 Q16531 1/20 0.32
▸ CRBN Q96SW2 1/20 0.32
▸ GPR119 Q8TDV5 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ CNR2 P34972 1/20 0.31
▸ PDK2 Q15119 2/20 0.31
▸ PDK4 Q16654 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALOX5AP P20292 1/20 0.30
▸ FEN1 P39748 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
SCHEMBL23259227 0.76 ELANE (0.36) ELANEMEN1KMT2AATMKDM1A
SCHEMBL23258688 0.71 MAOA (0.35) ELANEGPR119CNR2ALOX5APFEN1
SCHEMBL23258832 0.70 PDE4B (0.40) ELANE
SCHEMBL2761277 0.70 ELANE (0.49) ELANEMEN1KMT2AATMKDM1A
SCHEMBL23258869 0.70 ELANE (0.42) ELANEMEN1KMT2AKDM1APDK2
SCHEMBL17171697 0.70 PTGDR2 (0.40) ELANEMEN1KMT2AKDM1AGPR119
SCHEMBL23258472 0.69 HTR2C (0.43) HTR6HTR2CNOTUMPDK2PDK4
SCHEMBL1790296 0.69 PTGDR2 (0.52) ELANEMEN1KMT2AHTR2C
SCHEMBL23258478 0.68 GABRA1 (0.43) ELANE
SCHEMBL2221010 0.67 ELANE (0.49) ELANEKMT2AKDM1ADDB1CRBN

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-2021076938-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS Ambys Medicines, Inc. (US) 2021-04-22 — — WO disclosed
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