SCHEMBL30728859

SCHEMBL30728859

CC(C)(C)OC(=O)N1[C@@]2(C)CC[C@]1(C)CC(Nc1ccc(Cl)nn1)C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 2/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CDK9 P50750 1/20 0.33
CCNT1 O60563 1/20 0.33
SYK P43405 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
POLB P06746 1/20 0.33
CHRM3 P20309 1/20 0.33
MEN1 O00255 2/20 0.32
STS P08842 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CNR1 P21554 2/20 0.32

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
SCHEMBL22214268 1.00 KMT2A (0.38) KMT2ALMNAALDH1A1NPC1MAPT
SCHEMBL29628212 1.00 KMT2A (0.38) KMT2ALMNAALDH1A1NPC1MAPT
SCHEMBL25174104 0.87 ALDH1A1 (0.34) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL29860367 0.87 ALDH1A1 (0.34) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL29860167 0.87 ALDH1A1 (0.34) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL22214205 0.86 CDK9 (0.30) KMT2ALMNAALDH1A1NPC1MAPT
SCHEMBL22205446 0.84 POLB (0.34) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL22205449 0.84 POLB (0.34) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL23397596 0.84 POLB (0.34) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL20705026 0.84 POLB (0.34) KMT2ALMNAALDH1A1MAPTHTT

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-111194215-B Methods and compositions for modulating splicing 斯基霍克疗法公司 2024-03-01 CN disclosed
CN-111499615-B Methods and compositions for modulating splicing 斯基霍克疗法公司 2024-02-02 CN disclosed