SCHEMBL29973993

SCHEMBL29973993

CCN1c2ccccc2SC1P

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GSK3B P49841 7/20 0.36
▸ MAOA P21397 1/20 0.35
▸ KDM1A O60341 2/20 0.35
▸ PPARG P37231 1/20 0.34
▸ BCHE P06276 1/20 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
Iodide SCHEMBL8924984 0.81 SMN1; SMN2 (0.37) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL30702419 0.79 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL1046284 0.79 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL1573679 0.78 PPARG (0.37) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL1412788 0.78 PPARG (0.37) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL31571120 0.78 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL2748081 0.78 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL9305366 0.78 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL2364685 0.76 GSK3B (0.39) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A
SCHEMBL514686 0.75 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2GSK3BMAOAKDM1A

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-115768473-A Bispecific antigen binding molecules targeting OX40 and FAP 豪夫迈·罗氏有限公司 2023-03-07 — — CN disclosed
CN-115398001-A Compositions and methods for producing 2, 5-furandicarboxylic acid 索鲁根公司 2022-11-25 — — CN disclosed
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