SCHEMBL1793962

SCHEMBL1793962

O=C(O)[C@H](Cc1c[nH]cn1)Nc1ncc[nH]1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.41
▸ ITGB3 P05106 3/20 0.32
▸ ITGAV P06756 3/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KMT2A Q03164 1/20 0.31
▸ FFAR2 O15552 1/20 0.31
▸ ITGA2B P08514 2/20 0.31
▸ GRIA1 P42261 1/20 0.30
▸ GRIA2 P42262 1/20 0.30
▸ GRIA3 P42263 1/20 0.30
▸ GRIA4 P48058 1/20 0.30

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
SCHEMBL8412037 0.80 FDPS (0.40) FDPSITGB3ITGAVSMN1; SMN2KMT2A
SCHEMBL21067601 0.78 — —
SCHEMBL4318206 0.78 — —
SCHEMBL669445 0.77 CPB2 (0.34) SMN1; SMN2
SCHEMBL3378638 0.77 CPB2 (0.34) SMN1; SMN2
SCHEMBL669444 0.77 CPB2 (0.34) SMN1; SMN2
Hydrochloric Acid SCHEMBL30634622 0.77 CPB2 (0.34) SMN1; SMN2
SCHEMBL3378642 0.77 CPB2 (0.34) SMN1; SMN2
SCHEMBL11208660 0.77 PPARG (0.40) SMN1; SMN2KMT2A
SCHEMBL11208659 0.77 PPARG (0.40) SMN1; SMN2KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116328840-B Heme-based chimeric oligopeptide-DNA mimic enzyme and application 南京大学 2024-08-23 — — CN disclosed
CN-116328840-A Heme-based chimeric oligopeptide-DNA mimic enzyme and application 南京大学 2023-06-27 — — CN disclosed
US-7951905-B2 Synthesis of carbohydrate-templated amino acids and methods of using same UNIVERSITY OF MANITOBA (CA) 2011-05-31 — — US disclosed
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