SCHEMBL25879657

SCHEMBL25879657

CCOC(=O)c1cc2ccncc2c(-c2cccc(CC)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 1/20 0.48
▸ CDC7 O00311 4/20 0.44
▸ DBF4 Q9UBU7 4/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ GSK3B P49841 1/20 0.40
▸ ELANE P08246 1/20 0.40
▸ GABRA2 P47869 2/20 0.40
▸ GABRB2 P47870 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ PPID Q08752 1/20 0.40
▸ MMP2 P08253 1/20 0.40
▸ MMP13 P45452 1/20 0.40
▸ MMP14 P50281 1/20 0.40
▸ PAX8 Q06710 1/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38

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
SCHEMBL25879656 0.87 CFD (0.53) CFD
SCHEMBL21455335 0.85 PPID (0.45) CFDCYP1A2GSK3BPPIDROCK2
SCHEMBL31373449 0.76 CYP1A2 (0.45) CDC7DBF4CYP1A2ELANEGABRA2
SCHEMBL212240 0.76 CYP1A2 (0.45) CDC7DBF4CYP1A2ELANEGABRA2
SCHEMBL25879654 0.76 CFD (0.72) CFDKDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL10990045 0.74 CYP1A2 (0.54) CYP1A2GABRA2GABRB2KDM4EALDH1A1
SCHEMBL21455336 0.74 CFD (0.79) CFDPPIDROCK2
SCHEMBL21561820 0.74 NAMPT (0.43) CFDCYP1A2PPID
SCHEMBL21455344 0.72 CFD (0.47) CFDCYP1A2PPID
SCHEMBL2728132 0.69 GABRA1 (0.49) CDC7DBF4CYP1A2GABRA2GABRB2

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-11708347-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2023-07-25 — — 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-11708347-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors C9, C5, C1QBP CFD 17/4885CDC7 2850/4885DBF4 30/4885

“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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