SCHEMBL31548232

SCHEMBL31548232

CC(C)(C)OC(=O)N1CC2(CC(Oc3cnc4ccc(Br)cc4n3)C2)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 1/20 0.41
▸ GPR119 Q8TDV5 4/20 0.39
▸ DGAT1 O75907 1/20 0.39
▸ P2RX3 P56373 1/20 0.39
▸ P2RX2 Q9UBL9 1/20 0.39
▸ EHMT2 Q96KQ7 1/20 0.38
▸ PIK3CD O00329 2/20 0.37
▸ PIK3CA P42336 2/20 0.37
▸ PIK3CG P48736 2/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ RORC P51449 2/20 0.37
▸ ACACB O00763 2/20 0.36
▸ OXTR P30559 1/20 0.36
▸ AVPR1A P37288 1/20 0.36
▸ ABHD6 Q9BV23 2/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.36
▸ WNT1 P04628 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ DYRK1A Q13627 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
SCHEMBL31548343 0.91 NAMPT (0.44) GPR119DGAT1ACACB
SCHEMBL31548403 0.89 KRAS (0.41) KRASGPR119P2RX3P2RX2EHMT2
SCHEMBL31548192 0.85 GPR119 (0.52) GPR119DGAT1PIK3CDPIK3CAPIK3CG
SCHEMBL20129206 0.83 DGAT1 (0.55) KRASGPR119DGAT1P2RX3P2RX2
SCHEMBL31548056 0.80 NAMPT (0.44) GPR119ACACBCYP11B2
SCHEMBL31548247 0.79 PIK3CD (0.51) KRASGPR119EHMT2PIK3CDPIK3CA
SCHEMBL31548271 0.79 GPR119 (0.41) KRASGPR119P2RX3P2RX2ABHD6
SCHEMBL29799526 0.77 RORC (0.47) GPR119P2RX3P2RX2RORCABHD6
SCHEMBL24753744 0.76 USP30 (0.40) KRASGPR119PIK3CDPIK3CAPIK3CG
SCHEMBL24752969 0.76 CHEK2 (0.48) GPR119

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-2025096858-A1 COMPOUNDS FOR THE DEGRADATION OF MUTANT BRAF C4 THERAPEUTICS, INC. (US) 2025-05-08 — — WO disclosed
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