SCHEMBL31561471

SCHEMBL31561471

CN(C)c1ccccc1-c1c2nc(c(-c3ccccc3N(C)C)c3ccc([nH]3)c(-c3ccccc3N(C)C)c3nc(c(-c4ccccc4N(C)C)c4ccc1[nH]4)C=C3)C=C2

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 3/20 0.45
▸ TERT O14746 3/20 0.43
▸ CYCS P99999 2/20 0.38
▸ PTGES O14684 1/20 0.37
▸ ENPP2 Q13822 1/20 0.37

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
SCHEMBL2639721 1.00 TOP1 (0.45) TOP1TERTCYCSPTGESENPP2
SCHEMBL17996679 0.85 TERT (0.42) TOP1TERTCYCSENPP2
SCHEMBL4960201 0.81 STAT3 (0.54) TOP1PTGES
SCHEMBL17996677 0.80 TERT (0.46) TOP1TERTCYCSENPP2
SCHEMBL30081960 0.78 TERT (0.46) TOP1TERTCYCSENPP2
SCHEMBL17996674 0.78 TERT (0.36) TOP1TERTCYCS
SCHEMBL28469388 0.77 TERT (0.45) TOP1TERTCYCSENPP2
Hydrochloric Acid SCHEMBL30945655 0.77 TERT (0.45) TOP1TERTCYCSENPP2
SCHEMBL9365601 0.75 TERT (0.42) TOP1TERTCYCSENPP2
SCHEMBL5918752 0.75 TERT (0.42) TOP1TERTCYCSENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119792519-A Supermolecule porphyrin phthalocyanine nano-assembly and preparation method and application thereof 南宁师范大学 2025-04-11 — — CN disclosed
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