SCHEMBL38654028

SCHEMBL38654028

NC(=O)c1nn(Cc2cccnn2)c2c1CCNC2

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.34
▸ JAK1 P23458 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ MAP3K14 Q99558 1/20 0.34
▸ F12 P00748 6/20 0.32
▸ HTR7 P34969 1/20 0.32
▸ CDK2 P24941 3/20 0.31
▸ CCNA2 P20248 2/20 0.31
▸ CCNA1 P78396 2/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ PDPK1 O15530 1/20 0.31

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
SCHEMBL38653833 0.80 CCNA2 (0.41) HTR7CDK2CCNA2CCNA1
SCHEMBL38652766 0.80 CCNA2 (0.36) F12HTR7CDK2CCNA2CCNA1
SCHEMBL31706984 0.71 HTR7 (0.58) HTR7CDK2CCNA2CCNA1HDAC1
SCHEMBL23296450 0.71 GRM1 (0.35) MAP3K14F12CDK2CCNA2CCNA1
SCHEMBL6806341 0.69 CTDSP1 (0.38) JAK2JAK1CYP1A2BTKGRIN1
SCHEMBL6441740 0.68 CTDSP1 (0.36) JAK2JAK1CYP1A2GRIN1GRIN2B
SCHEMBL17317922 0.66 IDH1 (0.42) HTR7
SCHEMBL6448402 0.65 CTDSP1 (0.37) CYP1A2GRIN1GRIN2B
Hydrochloric Acid SCHEMBL17317665 0.65 IDH1 (0.42) HTR7
SCHEMBL38652998 0.65 CCNA2 (0.54) MAP3K14CDK2CCNA2CCNA1

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-20260132132-A1 3A,4,5,6-TETRAHYDRO-1 H-PYRAZOLO[3,4-C]PYRIDIN-7(7AH)-ONE DERIVATIVES AS FACTOR XIIA INHIBITORS KALVISTA PHARMACEUTICALS LTD (GB) 2026-05-14 — — 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-20260132132-A1 3A,4,5,6-TETRAHYDRO-1 H-PYRAZOLO[3,4-C]PYRIDIN-7(7AH)-ONE DERIVATIVES AS FACTOR XIIA INHIBITORS F11, F13B, F7 JAK2 1560/4885JAK1 1008/4885CYP1A2 111/4885

“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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