SCHEMBL31159634

SCHEMBL31159634

CCOc1ccc(NC(=O)CSc2nnc(CCn3c4ccccc4c4ccccc43)o2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.57
KMT2A Q03164 1/20 0.57
MAPT P10636 3/20 0.55
TP53 P04637 1/20 0.55
ALDH1A1 P00352 1/20 0.55

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
SCHEMBL31159517 0.89 MAPT (0.55) SMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL31159510 0.88 ALDH1A1 (0.65) KMT2AMAPTALDH1A1
SCHEMBL31159569 0.88 KMT2A (0.64) KMT2AMAPTALDH1A1
SCHEMBL31159502 0.86 NPSR1 (0.65) KMT2AMAPTALDH1A1
SCHEMBL31159556 0.86 GSK3B (0.62) KMT2AMAPTALDH1A1
SCHEMBL31159568 0.83 MAPT (0.59) SMN1; SMN2KMT2AMAPTTP53ALDH1A1
SCHEMBL31159591 0.81 MAPT (0.66) SMN1; SMN2MAPTTP53ALDH1A1
SCHEMBL31159567 0.80 MAPT (0.58) MAPTALDH1A1
SCHEMBL31159548 0.77 ALDH1A1 (0.67) MAPTTP53ALDH1A1
SCHEMBL31159545 0.75 KMT2A (0.69) KMT2AMAPTALDH1A1

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-118496218-A Carbazole-oxadiazole alpha-glucosidase and alpha-amylase double-target inhibitor and preparation method and application thereof 贵州医科大学 2024-08-16 CN disclosed