SCHEMBL29697208

SCHEMBL29697208

Nc1c(N=Nc2ccc(-c3ccccc3)nc2)cc(S(=O)(=O)O)c2ccccc12

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.69
▸ ALDH1A1 P00352 1/20 0.69
▸ APP P05067 1/20 0.69
▸ MAPT P10636 1/20 0.69
▸ THRB P10828 1/20 0.69
▸ HPGD P15428 1/20 0.69
▸ ALOX12 P18054 1/20 0.69
▸ SNCA P37840 1/20 0.69
▸ RECQL P46063 1/20 0.69
▸ BLM P54132 1/20 0.69
▸ KMT2A Q03164 1/20 0.69
▸ TDP1 Q9NUW8 1/20 0.69
▸ SUMO2 P61956 1/20 0.68
▸ SUMO1 P63165 1/20 0.68
▸ SENP7 Q9BQF6 1/20 0.68
▸ SENP2 Q9HC62 1/20 0.68
▸ SENP1 Q9P0U3 1/20 0.68
▸ SLC7A11 Q9UPY5 3/20 0.62

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
SCHEMBL15120143 1.00 MEN1 (0.69) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL18044221 1.00 MEN1 (0.69) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL14988368 0.99 MEN1 (0.67) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL14988362 0.99 MEN1 (0.67) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL29697129 0.94 MEN1 (0.67) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL15120182 0.94 MEN1 (0.67) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL18044255 0.94 MEN1 (0.67) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL14988274 0.93 MEN1 (0.65) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL14988269 0.93 MEN1 (0.65) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL18044207 0.92 MEN1 (0.67) MEN1ALDH1A1APPMAPTTHRB

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-118434418-A Composition for improving cardiac function 国立大学法人京都大学 2024-08-02 — — CN claimed
CN-114599370-A Pharmaceutical composition for protecting cartilage 国立大学法人京都大学 2022-06-07 — — CN claimed
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