SCHEMBL27893430

SCHEMBL27893430

Cc1cc(-c2cncc(CNC(=O)c3ccc(-c4cnccn4)cn3)c2)ccn1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 7/20 0.54
PORCN Q9H237 10/20 0.52
KCNH2 Q12809 1/20 0.51
GRIN2B Q13224 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL246101 0.86 WNT3A (0.65) WNT3APORCN
SCHEMBL248713 0.86 WNT3A (0.52) WNT3APORCN
SCHEMBL27910498 0.86 KCNH2 (0.50) WNT3AKCNH2GRIN2BSMN1; SMN2
SCHEMBL248168 0.85 WNT3A (0.55) WNT3APORCN
SCHEMBL27893431 0.84 KCNH2 (0.53) WNT3APORCNKCNH2GRIN2B
SCHEMBL27893462 0.83 KCNH2 (0.48) WNT3APORCNKCNH2GRIN2B
SCHEMBL27893473 0.83 WNT3A (0.55) WNT3APORCN
Fumaric Acid SCHEMBL248599 0.82 WNT3A (0.59) WNT3APORCN
Fumaric Acid SCHEMBL248600 0.82 WNT3A (0.59) WNT3APORCN
SCHEMBL248408 0.80 WNT3A (0.48) WNT3APORCN

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-102958917-B Compositions and methods for modulating the wnt signaling pathway IRM LLC (BM) 2014-10-08 CN disclosed
CN-102958917-A Compositions and methods for modulating the wnt signaling pathway IRM LLC 2013-03-06 CN disclosed