SCHEMBL19826993

SCHEMBL19826993

CCOC(=O)c1cnn2ccc(N[C@H](C)c3cc(F)cc(B4OC(C)(C)C(C)(C)O4)c3OCCNC(=O)OC(C)(C)C)nc12

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 14/20 0.36
▸ NTRK3 Q16288 7/20 0.36
▸ NTRK2 Q16620 6/20 0.36
▸ JAK2 O60674 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ TGFBR1 P36897 2/20 0.34
▸ IRAK4 Q9NWZ3 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
SCHEMBL19827028 0.88 NTRK1 (0.39) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL19826941 0.87 NTRK1 (0.39) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL16947092 0.84 NTRK1 (0.46) NTRK1NTRK3NTRK2JAK2
SCHEMBL29422688 0.79 NTRK1 (0.39) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL19827083 0.79 NTRK1 (0.41) NTRK1NTRK3NTRK2TGFBR1IRAK4
SCHEMBL29422764 0.79 NTRK1 (0.38) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL29422547 0.79 NTRK1 (0.38) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL22695326 0.79 NTRK1 (0.38) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL22688714 0.78 NTRK1 (0.40) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL22688782 0.78 NTRK1 (0.38) NTRK1NTRK3NTRK2

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-10689400-B2 Macrocycle kinase inhibitors Turning Point Therapeutics, Inc. (US) 2020-06-23 — — US disclosed
US-20190169208-A1 MACROCYCLE KINASE INHIBITORS TP THERAPEUTICS, INC. 2019-06-06 — — US disclosed
WO-2018022911-A1 MACROCYCLE KINASE INHIBITORS TP THERAPEUTICS, INC. (US) 2018-02-01 — — WO 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 (2 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-20190169208-A1 MACROCYCLE KINASE INHIBITORS DCK, MAP3K20, PLK1 NTRK1 964/4885NTRK3 790/4885NTRK2 1605/4885
US-10689400-B2 Macrocycle kinase inhibitors DCK, MAP3K20, PLK1 NTRK1 964/4885NTRK3 790/4885NTRK2 1605/4885

“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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