SCHEMBL38652197

SCHEMBL38652197

CC(C)(C)OC(=O)N1CCC(F)(c2cc(Br)ccc2F)C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 6/20 0.45
USP30 Q70CQ3 4/20 0.44
HDAC2 Q92769 2/20 0.41
SCD5 Q86SK9 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
HDAC1 Q13547 2/20 0.39
TNKS O95271 1/20 0.39
PARP1 P09874 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ESR2 Q92731 1/20 0.38
CYP11B2 P19099 1/20 0.38
BACE1 P56817 1/20 0.38

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
SCHEMBL38652363 0.86 RORC (0.45) RORCUSP30HDAC2SCD5GPR119
SCHEMBL20242150 0.86 RORC (0.45) RORCUSP30HDAC2SCD5GPR119
SCHEMBL20243053 0.86 RORC (0.45) RORCUSP30HDAC2SCD5GPR119
SCHEMBL22300718 0.84 USP30 (0.47) RORCUSP30HDAC2ESR2
SCHEMBL38652021 0.81 USP30 (0.49) RORCUSP30SCD5GPR119CYP11B2
SCHEMBL31283755 0.80 RORC (0.45) RORCUSP30SCD5GPR119HDAC1
SCHEMBL1200040 0.77 RORC (0.53) RORCGPR119BACE1
SCHEMBL23291555 0.77 USP30 (0.48) RORCUSP30HDAC2GPR119HDAC1
SCHEMBL31498603 0.76 CYP11B2 (0.53) RORCUSP30HDAC2SCD5GPR119
SCHEMBL1175585 0.76 USP30 (0.40) RORCUSP30GPR119HDAC1PARP1

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
CN-122010910-A Biazacycloalkane Menin-MLL protein inhibitor, pharmaceutical composition and application thereof 赛诺哈勃药业(成都)有限公司 2026-05-12 CN disclosed