SCHEMBL22075333

SCHEMBL22075333

Fc1ccc(Cl)cc1-c1[nH]cnc1-c1ccc2ncc(-c3cn[nH]c3)cc2c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TNIK Q9UKE5 1/20 0.39
▸ ACVR1 Q04771 1/20 0.39
▸ IDO1 P14902 3/20 0.39
▸ TGFBR1 P36897 2/20 0.39
▸ MAPK14 Q16539 4/20 0.38
▸ ROCK2 O75116 5/20 0.36
▸ MET P08581 1/20 0.35
▸ PDGFRB P09619 1/20 0.34
▸ PDGFRA P16234 1/20 0.34
▸ AKT1 P31749 1/20 0.34

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
SCHEMBL22075155 0.88 ACVR1 (0.35) ACVR1TGFBR1MAPK14ROCK2MET
SCHEMBL22075305 0.84 PIM1 (0.36) TGFBR1ROCK2METPDGFRBPDGFRA
SCHEMBL22075061 0.83 TNIK (0.41) TNIKIDO1TGFBR1MAPK14
SCHEMBL22075360 0.82 FEN1 (0.37) TGFBR1ROCK2METPDGFRBPDGFRA
SCHEMBL25084517 0.81 TGFBR1 (0.44) TNIKACVR1TGFBR1MAPK14ROCK2
SCHEMBL22075158 0.80 TNIK (0.42) TNIKIDO1TGFBR1MAPK14PDGFRB
SCHEMBL22074805 0.76 HTR6 (0.44) TNIKMET
SCHEMBL22074906 0.76 MAPK14 (0.39) TNIKIDO1MAPK14MET
SCHEMBL22075246 0.75 MAPK14 (0.35) TNIKIDO1TGFBR1MAPK14
SCHEMBL22074971 0.75 KDM4E (0.37) MAPK14AKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11730720-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-08-22 — — US disclosed
US-11730720-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-08-22 — — US disclosed
US-11730720-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-08-22 — — US disclosed
US-20210154178-A1 ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-05-27 — — US disclosed
US-20210154178-A1 ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-05-27 — — US disclosed
US-10952996-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-03-23 — — US disclosed
US-10952996-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-03-23 — — US disclosed
WO-2020123453-A2 ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-06-18 — — WO disclosed
US-20200188370-A1 ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-06-18 — — US disclosed
US-20200188370-A1 ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-06-18 — — 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 (4 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-10952996-B2 ALK5 inhibitors ALK, ACVR1, ACVRL1 TNIK 176/4885ACVR1 2/4885IDO1 3400/4885
US-20210154178-A1 ALK5 INHIBITORS ALK, ACVR1, ACVRL1 TNIK 176/4885ACVR1 2/4885IDO1 3400/4885
US-11730720-B2 ALK5 inhibitors ALK, ACVR1, ACVRL1 TNIK 176/4885ACVR1 2/4885IDO1 3400/4885
US-20200188370-A1 ALK5 INHIBITORS ALK, ACVR1, ACVRL1 TNIK 176/4885ACVR1 2/4885IDO1 3400/4885

“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.

Send feedback