SCHEMBL23259175

SCHEMBL23259175

CC(C)(C)OC(=O)Oc1ccc(C2CC3CC3C2)ccc1=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.41
▸ ELANE P08246 1/20 0.37
▸ PDE4B Q07343 3/20 0.31
▸ NR3C1 P04150 1/20 0.31
▸ PDE4A P27815 1/20 0.30
▸ PDE4C Q08493 1/20 0.30
▸ PDE4D Q08499 1/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ NAMPT P43490 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
SCHEMBL23259163 0.85 KDM1A (0.39) KDM1AELANEPDE4BPDE4APDE4C
SCHEMBL23258503 0.83 KDM1A (0.37) KDM1AELANEPDE4BPDE4APDE4C
SCHEMBL23259206 0.79 QDPR (0.47) KDM1APDE4BNAMPT
SCHEMBL23258889 0.79 KDM1A (0.36) KDM1AELANEPDE4BPDE4APDE4C
SCHEMBL23258827 0.76 ELANE (0.45) KDM1AELANEBRD4
SCHEMBL23258874 0.76 ELANE (0.45) KDM1AELANEBRD4
SCHEMBL23258525 0.75 KDM1A (0.42) KDM1AELANEPDE4BPDE4APDE4C
SCHEMBL23258561 0.75 ELANE (0.44) KDM1AELANEBRD4
SCHEMBL23249891 0.75 ELANE (0.44) KDM1AELANEBRD4
SCHEMBL27018128 0.75 ELANE (0.44) KDM1AELANEBRD4

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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