SCHEMBL30710394

SCHEMBL30710394

COC(=O)c1ccc2c(c1)C(c1ccccc1F)N(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.41
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
TRPM8 Q7Z2W7 3/20 0.38
NR1H2 P55055 1/20 0.38
GHSR Q92847 2/20 0.37
UCHL1 P09936 1/20 0.37
USP30 Q70CQ3 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LHCGR P22888 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RBP4 P02753 1/20 0.37

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
SCHEMBL30710404 0.90 LMNA (0.42) HDAC1HDAC6NR1H2GHSRUCHL1
SCHEMBL30710250 0.90 LMNA (0.42) HDAC1HDAC6NR1H2GHSRUCHL1
SCHEMBL29560706 0.85 TRPV1 (0.52) CHRM3TRPM8MEN1KMT2A
SCHEMBL30710358 0.85 MEN1 (0.48) CHRM3TRPM8NR1H2GHSRUSP30
SCHEMBL30710500 0.82 TRPM8 (0.41) TRPM8NR1H2UCHL1USP30MEN1
SCHEMBL29405461 0.81 NR1H2 (0.43) HDAC1HDAC6NR1H2GHSRUCHL1
SCHEMBL30734308 0.79 ESR1 (0.51) CHRM3GHSRMEN1KMT2AALDH1A1
SCHEMBL27276906 0.79 ESR1 (0.51) CHRM3GHSRMEN1KMT2AALDH1A1
SCHEMBL30734235 0.79 ESR1 (0.51) CHRM3GHSRMEN1KMT2AALDH1A1
SCHEMBL30710294 0.76 NR1H2 (0.42) HDAC1HDAC6NR1H2MEN1KMT2A

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-2023250439-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. (US) 2023-12-28 WO disclosed