SCHEMBL31158858

SCHEMBL31158858

CC(C)(C)OC(=O)N1CC2(C=C(c3ccc(C(F)(F)F)cc3F)C2)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ RORC P51449 8/20 0.40
▸ GPR119 Q8TDV5 4/20 0.39
▸ TACR1 P25103 1/20 0.38
▸ PDK2 Q15119 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ PTK2 Q05397 1/20 0.37
▸ STS P08842 1/20 0.36
▸ ALOX5AP P20292 1/20 0.36
▸ FEN1 P39748 1/20 0.36
▸ EIF2AK4 Q9P2K8 1/20 0.36

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
SCHEMBL31158852 0.87 SMN1; SMN2 (0.40) RORCGPR119PDK2ALOX5APFEN1
SCHEMBL31158818 0.82 MAPT (0.47) MAPTRORCGPR119TACR1
SCHEMBL31159140 0.82 PDK2 (0.40) RORCGPR119PDK2JAK2ALOX5AP
SCHEMBL31029069 0.82 ALDH1A1 (0.47) MAPTRORCGPR119PDK2ALOX5AP
SCHEMBL31158870 0.78 KIF11 (0.41) RORCGPR119ALOX5APFEN1
SCHEMBL31158817 0.78 APP (0.40) APPRORC
SCHEMBL31159047 0.77 MMP13 (0.40) RORCGPR119JAK2ALOX5APFEN1
SCHEMBL23850253 0.75 MAPT (0.40) MAPTRORCGPR119TACR1STS
SCHEMBL23850280 0.73 ABHD6 (0.44) MAPTRORCGPR119TACR1STS
SCHEMBL31549809 0.73 ABHD6 (0.44) MAPTRORCGPR119TACR1STS

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-2024201248-A1 COMPOUNDS AND METHODS FOR DEGRADING GSPT1 PIN THERAPEUTICS, INC. (KR) 2024-10-03 — — WO disclosed
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