SCHEMBL18361553

SCHEMBL18361553

CCOC(=O)c1cnn2ccc(N[C@H](CC#N)c3cc(F)ccc3O[C@@H](C)CNC(=O)OC(C)(C)C)nc12

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MKNK2 Q9HBH9 5/20 0.36
▸ NTRK1 P04629 13/20 0.36
▸ NTRK3 Q16288 8/20 0.36
▸ NTRK2 Q16620 6/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.35
▸ PCSK9 Q8NBP7 1/20 0.35
▸ JAK2 O60674 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
SCHEMBL20359956 0.90 NTRK1 (0.43) MKNK2NTRK1NTRK3NTRK2
SCHEMBL21815180 0.90 NTRK1 (0.43) MKNK2NTRK1NTRK3NTRK2
SCHEMBL20359954 0.90 NTRK1 (0.43) MKNK2NTRK1NTRK3NTRK2
SCHEMBL16946813 0.90 NTRK1 (0.43) MKNK2NTRK1NTRK3NTRK2
SCHEMBL18361487 0.88 MKNK2 (0.38) MKNK2NTRK1NTRK3NTRK2IRAK4
SCHEMBL18361486 0.87 NTRK1 (0.37) MKNK2NTRK1NTRK3NTRK2IRAK4
SCHEMBL18361488 0.87 NTRK1 (0.38) MKNK2NTRK1NTRK3NTRK2IRAK4
SCHEMBL31250788 0.83 NTRK1 (0.44) NTRK1NTRK3NTRK2PCSK9
SCHEMBL18361545 0.83 NTRK1 (0.43) NTRK1NTRK3NTRK2
SCHEMBL18361450 0.83 NTRK1 (0.44) NTRK1NTRK3NTRK2PCSK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11008337-B2 Chiral diaryl macrocycles as modulators of protein kinases Turning Point Therapeutics, Inc. (US) 2021-05-18 — — US disclosed
US-20190284209-A1 CHIRAL DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES Turning Point Therapeutics, Inc. 2019-09-19 — — US disclosed
US-20180186813-A1 CHIRAL DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES Turning Point Therapeutics, Inc. 2018-07-05 — — US disclosed
WO-2017004342-A1 CHIRAL DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES TP THERAPEUTICS, INC. (US) 2017-01-05 — — 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 (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-20180186813-A1 CHIRAL DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES MAP3K20, LCK, DAPK2 MKNK2 109/4885NTRK1 1462/4885NTRK3 2203/4885
US-20190284209-A1 CHIRAL DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES MAP3K20, LCK, DAPK2 MKNK2 109/4885NTRK1 1462/4885NTRK3 2203/4885
US-11008337-B2 Chiral diaryl macrocycles as modulators of protein kinases LCK, MAP3K20, MAP3K19 MKNK2 131/4885NTRK1 1409/4885NTRK3 2017/4885

“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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