SCHEMBL19763054

SCHEMBL19763054

CCOC(=O)Cc1ccc(-c2ccnc(C(F)F)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 7/20 0.50
▸ SYK P43405 2/20 0.50
▸ PPID Q08752 1/20 0.44
▸ RXRA P19793 1/20 0.42
▸ RXRB P28702 1/20 0.42
▸ RXRG P48443 1/20 0.42
▸ TBXAS1 P24557 1/20 0.41
▸ KDM5B Q9UGL1 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP4Z1 Q86W10 1/20 0.40
▸ CYP3A4 P08684 2/20 0.39
▸ PRKG2 Q13237 2/20 0.39
▸ AAK1 Q2M2I8 2/20 0.39

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
SCHEMBL12302554 0.83 WNT3A (0.56) WNT3ASYK
SCHEMBL12302767 0.81 WNT3A (0.56) WNT3ASYKRXRARXRBRXRG
SCHEMBL12303297 0.81 SYK (0.50) WNT3ASYKPPIDTBXAS1KDM5B
SCHEMBL68930 0.78 CYP4Z1 (0.57) PPIDTBXAS1KDM5BSMN1; SMN2NPC1
SCHEMBL12302777 0.77 SYK (0.55) WNT3ASYKPPIDRXRARXRB
SCHEMBL12126600 0.76 CYP4Z1 (0.53) SYKPPIDRXRARXRBRXRG
SCHEMBL24539024 0.73 CYP19A1 (0.44) SYKTBXAS1KDM5BSMN1; SMN2NPC1
SCHEMBL12302558 0.73 WNT3A (0.51) WNT3ASYKPPIDTBXAS1KDM5B
SCHEMBL27535179 0.72 PPID (0.39) PPIDMAOB
SCHEMBL68851 0.72 CYP4Z1 (0.62) TBXAS1SMN1; SMN2NPC1PKMNFKB1

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-10251893-B2 N-(hetero)aryl, 2-(hetero)aryl-substituted acetamides for use as Wnt signaling modulators NOVARTIS AG (CH) 2019-04-09 — — US disclosed
US-20180000832-A1 N-(HETERO)ARYL, 2-(HETERO)ARYL-SUBSTITUTED ACETAMIDES FOR USE AS WNT SIGNALING MODULATORS NOVARTIS AG (CH) 2018-01-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10251893-B2 N-(hetero)aryl, 2-(hetero)aryl-substituted acetamides for use as Wnt signaling modulators WNT1, CTNNB1, CTNNA1 WNT3A 4/4885SYK 3658/4885PPID 3725/4885
US-20180000832-A1 N-(HETERO)ARYL, 2-(HETERO)ARYL-SUBSTITUTED ACETAMIDES FOR USE AS WNT SIGNALING MODULATORS WNT1, CTNNB1, CTNNA1 WNT3A 4/4885SYK 3658/4885PPID 3725/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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