SCHEMBL5090090

SCHEMBL5090090

CCOC1(C(=O)O)C=Cc2cnccc2N1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 2/20 0.31
▸ CDC7 O00311 1/20 0.31
▸ DBF4 Q9UBU7 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CASP7 P55210 1/20 0.30
▸ KDM5A P29375 1/20 0.30
▸ KDM5B Q9UGL1 1/20 0.30
▸ KDM6B O15054 1/20 0.30

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
SCHEMBL20663619 0.66 GAA (0.31) MAPT
SCHEMBL31095199 0.62 GAA (0.44) KDM4CKDM4EALDH1A1MAPTKDM5B
Acetic Acid SCHEMBL28280160 0.61 KDM4C (0.33) KDM4CKDM4EALDH1A1MAPTKDM6B
SCHEMBL6166481 0.61 HSD11B1 (0.42) ALDH1A1
SCHEMBL16432722 0.59 KDM4C (0.39) KDM4CKDM4EALDH1A1MAPTKDM6B
SCHEMBL4654925 0.58 ALDH1A1 (0.32) KDM4CKDM4EALDH1A1MAPTKDM6B
SCHEMBL30440354 0.56 KDM4C (0.36) KDM4CKDM4EALDH1A1MAPTKDM6B
SCHEMBL8366169 0.56 KDM4C (0.36) KDM4CKDM4EALDH1A1MAPTKDM6B
SCHEMBL12324803 0.55 — —
SCHEMBL16187249 0.55 GAA (0.34) MAPT

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-20080207677-A1 Napthyridine Compounds As Rock Inhibitors GPC BIOTECH AG (DE) 2008-08-28 — — 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-20080207677-A1 Napthyridine Compounds As Rock Inhibitors ROCK2, ROCK1, RHOT2 KDM4C 3537/4885CDC7 332/4885DBF4 2459/4885

“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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