SCHEMBL29908618

SCHEMBL29908618

Cc1cc(-c2nn3c(c2-c2ccc4ncccc4c2)CCC3)c(F)cc1F

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 19/20 0.49
THRB P10828 6/20 0.49
MAP3K20 Q9NYL2 5/20 0.47
TGFBR2 P37173 5/20 0.46
CYP2D6 P10635 1/20 0.45
MAPK14 Q16539 1/20 0.41

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
SCHEMBL18123893 1.00 TGFBR1 (0.49) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL18115022 0.92 TGFBR1 (0.50) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL29908573 0.92 TGFBR1 (0.50) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL18124113 0.89 THRB (0.46) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL29908575 0.89 THRB (0.46) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL18115112 0.88 TGFBR1 (0.53) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL29908601 0.88 TGFBR1 (0.53) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL18114950 0.88 TGFBR1 (0.48) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL29908600 0.88 TGFBR1 (0.48) TGFBR1THRBMAP3K20TGFBR2CYP2D6
SCHEMBL29908605 0.86 THRB (0.53) TGFBR1THRBMAP3K20TGFBR2CYP2D6

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-12227508-B2 TGF-β inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2025-02-18 US disclosed
US-20230123591-A1 TGF-ß INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2023-04-20 US disclosed
US-11466018-B2 TGF-β inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2022-10-11 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 (3 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-12227508-B2 TGF-β inhibitors TGFBR1, TGFBR2, TGFB1 TGFBR1 1/4885THRB 102/4885MAP3K20 1663/4885
US-11466018-B2 TGF-β inhibitors TGFBR1, TGFBR2, TGFB1 TGFBR1 1/4885THRB 102/4885MAP3K20 1663/4885
US-20230123591-A1 TGF-ß INHIBITORS TGFBR1, TGFBR2, TGFB1 TGFBR1 1/4885THRB 86/4885MAP3K20 1763/4885

“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.