SCHEMBL24201142

SCHEMBL24201142

O=C(O)COC12CC3CC4CC(C1)C2(C4)C3

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.33
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.32
HSP90AA1 P07900 1/20 0.31
MEN1 O00255 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 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
SCHEMBL24201089 0.87 EPHX2 (0.34)
SCHEMBL24201269 0.86 EPHX2 (0.33)
SCHEMBL24201130 0.86 EPHX2 (0.33)
SCHEMBL24201320 0.79 EPHX2 (0.33)
SCHEMBL24201145 0.78 ALDH1A1 (0.33) HSD11B1ALDH1A1POLBKDM4EHTT
SCHEMBL24201095 0.78 EPHX2 (0.32)
SCHEMBL24201326 0.78 EPHX2 (0.32)
SCHEMBL24201102 0.78 EPHX2 (0.32)
SCHEMBL24201267 0.77 ALOX5AP (0.31)
SCHEMBL24201139 0.74 CYP19A1 (0.33) ALDH1A1

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-3618833-B1 TRIPARTITE ANDROGEN RECEPTOR ELIMINATORS, METHODS AND USES THEREOF SPG THERAPEUTICS INC (US) 2022-01-19 EP disclosed