SCHEMBL31478764

SCHEMBL31478764

Cn1cc(-c2ccc3ccncc3c2)cn1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 8/20 0.56
▸ WNT1 P04628 7/20 0.56
▸ CLK2 P49760 1/20 0.56
▸ CLK3 P49761 1/20 0.56
▸ PRKCZ Q05513 1/20 0.54
▸ MAPT P10636 2/20 0.52
▸ GSK3B P49841 6/20 0.51
▸ ABL1 P00519 1/20 0.49
▸ LOXL2 Q9Y4K0 1/20 0.48
▸ CCNC P24863 5/20 0.47
▸ CDK8 P49336 5/20 0.47
▸ PIM1 P11309 1/20 0.47
▸ PIM2 Q9P1W9 1/20 0.47
▸ PIK3CD O00329 1/20 0.47
▸ PIK3CA P42336 1/20 0.47
▸ PIK3CB P42338 1/20 0.47
▸ PI4KA P42356 1/20 0.47
▸ PIK3CG P48736 1/20 0.47
▸ PI4KB Q9UBF8 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
SCHEMBL25602112 0.94 DYRK1A (0.62) DYRK1AWNT1CLK2CLK3PRKCZ
SCHEMBL31501389 0.94 DYRK1A (0.62) DYRK1AWNT1CLK2CLK3PRKCZ
SCHEMBL30964876 0.81 ABL1 (0.52) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL30210556 0.77 MAPT (0.48) DYRK1AWNT1CLK2CLK3MAPT
SCHEMBL19643731 0.76 DYRK1A (0.47) DYRK1AWNT1CLK2CLK3MAPT
SCHEMBL30878058 0.76 DYRK1A (0.47) DYRK1AWNT1CLK2CLK3MAPT
SCHEMBL31071772 0.75 PIK3CD (0.48) DYRK1AWNT1GSK3BABL1CCNC
SCHEMBL25424298 0.75 ABL1 (0.56) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL359835 0.75 DYRK1A (0.53) DYRK1AWNT1CLK2MAPTGSK3B
SCHEMBL29650645 0.75 PRKCZ (0.75) DYRK1ACLK2PRKCZMAPTGSK3B

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-20250084074-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS MERCK PATENT GMBH (DE) 2025-03-13 — — 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-20250084074-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS VHL, CDKN1A, CCNI DYRK1A 3206/4885WNT1 970/4885CLK2 2049/4885

“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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