SCHEMBL18041963

SCHEMBL18041963

Cn1c(=O)n(C)c2cc(-c3[nH]cnc3-c3ccccc3)ccc21

nearest known ligand 0.90

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.90
CYP3A4 P08684 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
IDO1 P14902 4/20 0.47
GRM2 Q14416 1/20 0.43

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
SCHEMBL18041673 0.88 MAPK14 (0.90) MAPK14CYP3A4MAPT
SCHEMBL18041853 0.88 MAPK14 (1.00) MAPK14IDO1
SCHEMBL18041513 0.83 MAPK14 (0.69) MAPK14CYP3A4KDM4EMAPT
SCHEMBL5836210 0.81 MAPK14 (0.78) MAPK14MAPTIDO1
SCHEMBL18041632 0.81 MAPK14 (0.78) MAPK14MAPTIDO1
SCHEMBL18041709 0.81 MAPK14 (0.91) MAPK14CYP3A4KDM4EMAPTIDO1
SCHEMBL18041508 0.77 MAPK14 (0.86) MAPK14IDO1
SCHEMBL18041834 0.77 MAPK14 (0.80) MAPK14MAPTIDO1
SCHEMBL18041875 0.77 MAPK14 (0.80) MAPK14CYP3A4IDO1
SCHEMBL18041868 0.77 MAPK14 (0.86) MAPK14IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352360-B2 TGF-beta inhibitors Rigel Pharmaceuticals, hic. (US) 2022-06-07 US disclosed
CN-107406412-B TGF-beta inhibitors 里格尔药品股份有限公司 2021-07-16 CN disclosed
US-20200031832-A1 TGF-Beta Inhibitors MIDCAP FINANCIAL TRUST 2020-01-30 US disclosed
US-10287295-B2 TGF-β inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2019-05-14 US disclosed
US-20180127426-A1 TGF-Beta Inhibitors MIDCAP FINANCIAL TRUST 2018-05-10 US disclosed
US-9884868-B2 TGF-beta inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2018-02-06 US disclosed
US-20160257690-A1 TGF-Beta Inhibitors MIDCAP FINANCIAL TRUST 2016-09-08 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 (5 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-11352360-B2 TGF-beta inhibitors TGFBR1, TGFBR2, TGFB1 MAPK14 2266/4885CYP3A4 3457/4885KDM4E 1524/4885
US-20200031832-A1 TGF-Beta Inhibitors TGFBR1, TGFBR2, TGFB1 MAPK14 2266/4885CYP3A4 3457/4885KDM4E 1524/4885
US-20180127426-A1 TGF-Beta Inhibitors TGFBR1, TGFBR2, TGFB1 MAPK14 2266/4885CYP3A4 3457/4885KDM4E 1524/4885
US-10287295-B2 TGF-β inhibitors TGFBR1, TGFBR2, TGFB1 MAPK14 2085/4885CYP3A4 3442/4885KDM4E 1317/4885
US-20160257690-A1 TGF-Beta Inhibitors TGFBR1, TGFBR2, TGFB1 MAPK14 2266/4885CYP3A4 3457/4885KDM4E 1524/4885

“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.