SCHEMBL30366863

SCHEMBL30366863

CN1CCN(c2cc(-c3ccc(NC(=O)Cc4cccc(F)c4)nc3)ccn2)CC1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 15/20 0.61
▸ DYRK1A Q13627 4/20 0.57
▸ GSK3B P49841 3/20 0.57
▸ WNT1 P04628 2/20 0.57
▸ CLK2 P49760 1/20 0.57
▸ CLK3 P49761 1/20 0.57

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
SCHEMBL30367160 0.91 WNT3A (0.59) WNT3ADYRK1AGSK3BWNT1CLK2
SCHEMBL30367057 0.89 WNT3A (0.57) WNT3ADYRK1AGSK3BWNT1CLK2
SCHEMBL30367112 0.89 WNT3A (0.60) WNT3ADYRK1AGSK3BWNT1CLK2
SCHEMBL30366883 0.87 WNT3A (0.68) WNT3ADYRK1AGSK3BWNT1CLK2
SCHEMBL30367152 0.87 WNT3A (0.54) WNT3A
SCHEMBL30366840 0.81 TRPV1 (0.50) WNT3ADYRK1AGSK3BWNT1CLK2
SCHEMBL30366978 0.79 WNT3A (0.56) WNT3A
SCHEMBL30366740 0.79 RXRA (0.58) WNT3ADYRK1AGSK3BWNT1CLK2
SCHEMBL30367148 0.78 WNT3A (0.59) WNT3A
SCHEMBL31050200 0.77 WNT3A (0.57) WNT3A

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-116082310-B Bipyridine amide derivative, and preparation and application thereof 厦门大学 2024-08-20 — — CN disclosed
CN-116082310-A Bipyridine amide derivative, and preparation and application thereof 厦门大学 2023-05-09 — — CN disclosed
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