SCHEMBL30199066

SCHEMBL30199066

COc1cc(S(=O)(=O)N2CCC(N3CCOCC3)CC2)ccc1Nc1nc(NC(C)C)c2c(C#N)c[nH]c2n1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 7/20 0.56
▸ LRRK2 Q5S007 5/20 0.46
▸ DYRK1A Q13627 2/20 0.46
▸ ALK Q9UM73 3/20 0.43
▸ PTK2 Q05397 2/20 0.41
▸ SYK P43405 1/20 0.40

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
SCHEMBL22232854 1.00 TTK (0.56) TTKLRRK2DYRK1AALKPTK2
SCHEMBL30198920 0.94 TTK (0.58) TTKLRRK2PTK2SYK
SCHEMBL22232921 0.94 TTK (0.58) TTKLRRK2PTK2SYK
SCHEMBL22232831 0.93 TTK (0.52) TTKLRRK2DYRK1AALKPTK2
SCHEMBL30198982 0.93 TTK (0.52) TTKLRRK2DYRK1AALKPTK2
SCHEMBL22232830 0.93 TTK (0.52) TTKLRRK2DYRK1AALKPTK2
SCHEMBL30198752 0.93 TTK (0.52) TTKLRRK2DYRK1AALKPTK2
SCHEMBL22232907 0.93 TTK (0.52) TTKLRRK2DYRK1AALKPTK2
SCHEMBL22234022 0.92 TTK (0.56) TTKLRRK2DYRK1AALKPTK2
SCHEMBL30198691 0.92 TTK (0.56) TTKLRRK2DYRK1AALKPTK2

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
US-20230066011-A1 PYRROLOPYRIMIDINE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING PROTEIN KINASE-RELATED DISEASE COMPRISING SAME AS ACTIVE INGREDIENT VORONOIBIO CO., LTD. (KR) 2023-03-02 — — 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 (1 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-20230066011-A1 PYRROLOPYRIMIDINE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING PROTEIN KINASE-RELATED DISEASE COMPRISING SAME AS ACTIVE INGREDIENT LRRK2, BRCA1, PARK7 TTK 109/4885LRRK2 1/4885DYRK1A 271/4885

“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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