SCHEMBL30396299

SCHEMBL30396299

CC(C)(C)OC(=O)N1CCNCC1c1ncccc1C=Cc1ccccc1S(=O)(=O)Cc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NR1H2 P55055 4/20 0.36
NR1H3 Q13133 4/20 0.36
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
PARP1 P09874 1/20 0.34
REN P00797 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ACHE P22303 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
CA9 Q16790 2/20 0.33

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
SCHEMBL30396840 0.85 MEN1 (0.34) KMT2AMEN1ALDH1A1LMNATSHR
SCHEMBL27620945 0.75 NPC1 (0.41) KMT2AMEN1L3MBTL1PARP1
SCHEMBL27620947 0.72 PRMT5 (0.40) KMT2AMEN1TSHRL3MBTL1PARP1
SCHEMBL29773951 0.72 GPR119 (0.45) KMT2AMEN1ALDH1A1LMNATSHR
SCHEMBL27868891 0.72 GPR119 (0.45) KMT2AMEN1ALDH1A1LMNATSHR
SCHEMBL30974799 0.72 SRC (0.35) STSKMT2ANR1H2NR1H3PARP1
SCHEMBL28352935 0.72 PARP1 (0.46) KMT2AMEN1ALDH1A1LMNATSHR
SCHEMBL28505946 0.71 POLB (0.40) POLBPARP1
SCHEMBL4325057 0.71 NR1H2 (0.49) NR1H2NR1H3PARP1
SCHEMBL22285173 0.71 NR1H2 (0.49) NR1H2NR1H3PARP1

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
CN-115720578-B And tricyclic derivatives, preparation method and medical application thereof 深圳信立泰药业股份有限公司 2025-06-13 CN disclosed
CN-115720578-A Tricyclic derivative, preparation method and medical application thereof 深圳信立泰药业股份有限公司 2023-02-28 CN disclosed