SCHEMBL29258261

SCHEMBL29258261

O=S(=O)(NCc1ccc(Cl)cc1Cl)c1ccc(NC(=S)NCc2ccncc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 12/20 0.63
▸ ALDH1A1 P00352 4/20 0.61
▸ LMNA P02545 3/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61
▸ KMT2A Q03164 1/20 0.56
▸ MAPT P10636 3/20 0.55
▸ ALOX12 P18054 1/20 0.53
▸ PPARG P37231 1/20 0.53
▸ NCOA3 Q9Y6Q9 1/20 0.53
▸ HPGD P15428 1/20 0.53

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
SCHEMBL29258196 0.92 ALDH1A1 (0.61) NAMPTALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL29258243 0.90 NAMPT (0.78) NAMPT
SCHEMBL29258470 0.88 NAMPT (0.64) NAMPTALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL29258231 0.87 NAMPT (0.78) NAMPTALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL29258601 0.85 NAMPT (0.65) NAMPTALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL29258655 0.85 NAMPT (0.80) NAMPTALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL29258549 0.84 MAPT (0.66) NAMPTALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL29258244 0.83 NAMPT (0.60) NAMPTALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL29258263 0.83 NAMPT (0.77) NAMPT
SCHEMBL29258138 0.82 NAMPT (0.55) NAMPTALDH1A1LMNASMN1; SMN2MAPT

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-118108664-A NAMPT agonist and preparation method and application thereof 中国人民解放军海军军医大学 2024-05-31 — — CN claimed
CN-118108664-A NAMPT agonist and preparation method and application thereof 中国人民解放军海军军医大学 2024-05-31 — — CN disclosed
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