SCHEMBL30702419

SCHEMBL30702419

CCN1c2ccccc2SC1C

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAOA P21397 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM1A O60341 2/20 0.36
▸ PPARG P37231 1/20 0.35
▸ GSK3B P49841 2/20 0.35
▸ BCHE P06276 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL1046284 1.00 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1MAOAMEN1POLB
Iodide SCHEMBL8924984 0.98 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1MAOAMEN1POLB
SCHEMBL16709169 0.86 MAOA (0.38) SMN1; SMN2MAOAMEN1POLBKMT2A
SCHEMBL16709179 0.86 MAOA (0.42) SMN1; SMN2ALDH1A1MAOAMEN1POLB
SCHEMBL1049071 0.85 POLB (0.40) SMN1; SMN2ALDH1A1MAOAMEN1POLB
Quinoline SCHEMBL28758483 0.83 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1MEN1POLBKMT2A
SCHEMBL6313787 0.82 KDM1A (0.43) SMN1; SMN2ALDH1A1MAOAPOLBKDM1A
SCHEMBL21803246 0.81 KDM1A (0.39) ALDH1A1KDM1AGSK3BBCHE
SCHEMBL8861416 0.81 LMNA (0.37) SMN1; SMN2ALDH1A1MEN1POLBKMT2A
SCHEMBL7534194 0.80 MAOA (0.37) SMN1; SMN2ALDH1A1MAOAMEN1POLB

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-117263928-A Fluorescent probe and preparation method thereof 南通大学 2023-12-22 — — CN claimed
CN-117263928-A Fluorescent probe and preparation method thereof 南通大学 2023-12-22 — — CN disclosed
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