SCHEMBL30381702

SCHEMBL30381702

CN1CCC(c2nc3c(-c4cn(C)c5cnccc45)ccnc3[nH]2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.45
▸ TGFBR1 P36897 1/20 0.45
▸ IKBKE Q14164 1/20 0.45
▸ TBK1 Q9UHD2 1/20 0.45
▸ DYRK1A Q13627 3/20 0.44
▸ DYRK1B Q9Y463 2/20 0.44
▸ DYRK3 O43781 1/20 0.44
▸ IGF1R P08069 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ CLK1 P49759 1/20 0.44
▸ CLK2 P49760 1/20 0.44
▸ CDK5 Q00535 1/20 0.44
▸ CDK5R1 Q15078 1/20 0.44
▸ DYRK2 Q92630 1/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.44
▸ DYRK4 Q9NR20 1/20 0.44
▸ CDK9 P50750 12/20 0.43
▸ CCNT1 O60563 9/20 0.43
▸ NFATC1 O95644 1/20 0.43
▸ GSK3B P49841 1/20 0.43

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
SCHEMBL25428535 1.00 PDPK1 (0.45) PDPK1TGFBR1IKBKETBK1DYRK1A
SCHEMBL25858983 0.80 CDK9 (0.67) CDK9CCNT1
SCHEMBL31380019 0.80 CDK9 (0.67) CDK9CCNT1
SCHEMBL30381661 0.73 PARP1 (0.44) CDK9CCNT1PARP1
SCHEMBL25305073 0.73 PARP1 (0.44) CDK9CCNT1PARP1
SCHEMBL30769931 0.69 PARP1 (0.41) CDK9CCNT1PARP1
SCHEMBL27035288 0.69 PARP1 (0.41) CDK9CCNT1PARP1
SCHEMBL27058302 0.69 PARP1 (0.44) CDK9CCNT1PARP1
SCHEMBL27059126 0.68 CCNT1 (0.43) CDK9CCNT1PARP1
SCHEMBL30769916 0.68 PARP1 (0.40) CDK9CCNT1PARP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066349-A1 CYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2025-02-27 — — US disclosed
EP-4444420-A2 CYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Prothena Biosciences Limited (IE) 2024-10-16 — — EP disclosed
WO-2023107723-A2 METHODS FOR TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 — — WO 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-20250066349-A1 CYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF NEUROLOGICAL DISORDERS DYRK2, DYRK1A, PYGB PDPK1 61/4885TGFBR1 3625/4885IKBKE 602/4885

“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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