SCHEMBL23485984

SCHEMBL23485984

O=S(=O)(c1ccc2nc3ccc(NC[C@H](O)[C@@H](O)[C@H](O)CCO)cc3c(NCCCO)c2c1)N1CC(O)C1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.35
▸ RAD52 P43351 1/20 0.35
▸ TERT O14746 2/20 0.33
▸ AXL P30530 1/20 0.32
▸ TYRO3 Q06418 1/20 0.32
▸ MERTK Q12866 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ ADAM17 P78536 1/20 0.31
▸ JAK2 O60674 1/20 0.30
▸ JAK1 P23458 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
SCHEMBL24994174 0.91 TERT (0.33) POLBRAD52TERTAXLTYRO3
SCHEMBL23485853 0.87 ADAM17 (0.32) RXFP1LMNAADAM17JAK2JAK1
SCHEMBL23486017 0.85 POLB (0.39) POLBRAD52TERTALDH1A1LMNA
SCHEMBL23485837 0.82 POLB (0.41) POLBRAD52TERTAXLTYRO3
SCHEMBL23485753 0.82 POLB (0.36) POLBRAD52TERTALDH1A1KDM4E
SCHEMBL24995591 0.78 SMN1; SMN2 (0.48) POLBRAD52ALDH1A1LMNA
SCHEMBL24994173 0.77 POLB (0.40) POLBRAD52TERTALDH1A1LMNA
SCHEMBL24994845 0.77 PDE5A (0.33) RXFP1LMNAADAM17JAK2JAK1
SCHEMBL24994873 0.75 POLB (0.37) POLBRAD52TERTALDH1A1KDM4E
SCHEMBL23485986 0.74 MERTK (0.39) POLBRAD52TERTMERTKALDH1A1

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
US-20230040324-A1 AMINOACRIDINE AND AMINOPYRENE DYES AND THEIR USE AS FLUORESCENT TAGS, IN PARTICULAR FOR CARBOHYDRATE ANALYSIS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2023-02-09 — — US disclosed
WO-2021110280-A1 AMINOACRIDINE AND AMINOPYRENE DYES AND THEIR USE AS FLUORESCENT TAGS, IN PARTICULAR FOR CARBOHYDRATE ANALYSIS Max-Planck-Gesellschaft zur Förderung der Wissenschaften e. V. (DE) 2021-06-10 — — WO disclosed
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