SCHEMBL30488995

SCHEMBL30488995

CC(C)(C)OC(=O)c1ccc(N2CCC(C=O)CC2)nn1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SCD O00767 1/20 0.40
DCTPP1 Q9H773 2/20 0.39
GPR119 Q8TDV5 3/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 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
SCHEMBL29058449 1.00 MEN1 (0.40) MEN1KMT2ASMN1; SMN2SCDDCTPP1
SCHEMBL31330664 0.86 NPC1 (0.46) MEN1KMT2ASMN1; SMN2SCDDCTPP1
SCHEMBL27169428 0.86 MEN1 (0.48) MEN1KMT2ASMN1; SMN2SCDLMNA
SCHEMBL20046190 0.85 SCD (0.42) MEN1KMT2ASMN1; SMN2SCDDCTPP1
SCHEMBL20075853 0.83 SCD (0.44) MEN1KMT2ASMN1; SMN2SCDDCTPP1
SCHEMBL30488972 0.83 SCD (0.44) MEN1KMT2ASMN1; SMN2SCDDCTPP1
SCHEMBL31330813 0.83 HCRTR1 (0.34) SCDDCTPP1GPR119
SCHEMBL20046195 0.82 SCD (0.48) SCDDCTPP1
SCHEMBL31753642 0.82 HRH3 (0.44) GPR119
SCHEMBL24299446 0.80 MEN1 (0.43) MEN1KMT2ASMN1; SMN2GPR119LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025108404-A1 HETEROCYCLIC COMPOUND OF BIFUNCTIONAL CHIMERA FOR TARGETED DEGRADATION OF ANDROGEN RECEPTOR AND USE THEREOF 广东东阳光药业股份有限公司 2025-05-30 WO disclosed
CN-112010858-B BTK inhibitor, preparation method and pharmaceutical application thereof 四川海思科制药有限公司 2023-07-18 CN disclosed