SCHEMBL19827028

SCHEMBL19827028

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

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 16/20 0.39
▸ NTRK3 Q16288 8/20 0.39
▸ NTRK2 Q16620 6/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ TGFBR1 P36897 3/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ ADORA2A P29274 1/20 0.37

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
SCHEMBL19826941 0.92 NTRK1 (0.39) NTRK1NTRK3NTRK2JAK2TGFBR1
SCHEMBL16947092 0.89 NTRK1 (0.46) NTRK1NTRK3NTRK2JAK2
SCHEMBL19826993 0.88 NTRK1 (0.36) NTRK1NTRK3NTRK2JAK2TGFBR1
SCHEMBL19827027 0.86 NTRK1 (0.40) NTRK1JAK2TGFBR1ADORA3ADORA2A
SCHEMBL19827083 0.84 NTRK1 (0.41) NTRK1NTRK3NTRK2TGFBR1
SCHEMBL29422688 0.83 NTRK1 (0.39) NTRK1NTRK3NTRK2JAK2TGFBR1
SCHEMBL22688715 0.81 NTRK1 (0.40) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL22688714 0.81 NTRK1 (0.40) NTRK1NTRK3NTRK2JAK2ADORA3
SCHEMBL19826848 0.81 NTRK1 (0.40) NTRK1JAK2TGFBR1ADORA3ADORA2A
SCHEMBL16946813 0.80 NTRK1 (0.43) 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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