SCHEMBL4820518

SCHEMBL4820518

Cc1cccc(-c2nn3c(c2-c2ccc4c(ccn4C)c2)CCC3)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 18/20 1.00
MAP3K20 Q9NYL2 6/20 0.74
TGFBR2 P37173 6/20 0.71
THRB P10828 7/20 0.69
MAPK14 Q16539 3/20 0.67
CYP2D6 P10635 1/20 0.62

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
SCHEMBL4818169 0.85 TGFBR1 (1.00) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL411721 0.85 TGFBR1 (0.75) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL412490 0.84 TGFBR1 (1.00) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL373492 0.83 TGFBR1 (1.00) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL413111 0.82 TGFBR1 (1.00) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL414544 0.82 TGFBR1 (1.00) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL4823846 0.81 TGFBR1 (0.69) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL408963 0.80 TGFBR1 (0.69) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL4823880 0.80 TGFBR1 (0.68) TGFBR1MAP3K20TGFBR2THRBMAPK14
SCHEMBL4815692 0.80 TGFBR1 (0.68) TGFBR1MAP3K20TGFBR2THRBMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7405299-B2 Compounds as pharmaceutical agents ELI LILLY AND COMPANY (US) 2008-07-29 US claimed
US-7405299-B2 Compounds as pharmaceutical agents ELI LILLY AND COMPANY (US) 2008-07-29 US disclosed
US-7405299-B2 Compounds as pharmaceutical agents ELI LILLY AND COMPANY (US) 2008-07-29 US disclosed
US-7405299-B2 Compounds as pharmaceutical agents ELI LILLY AND COMPANY (US) 2008-07-29 US disclosed
US-20060058295-A1 Novel compounds as pharmaceutical agents ELI LILLY AND COMPANY (US) 2006-03-16 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-20060058295-A1 Novel compounds as pharmaceutical agents TGFB1, TGFB2, TGFBR1 TGFBR1 3/4885MAP3K20 105/4885TGFBR2 4/4885

“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.