SCHEMBL20796161

SCHEMBL20796161

CCOC(=O)c1c(N)nn2ccc(N3CCC[C@H]3c3cc(F)ccc3OC)nc12

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 20/20 0.54
▸ JAK2 O60674 10/20 0.54
▸ NTRK3 Q16288 1/20 0.46

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
SCHEMBL20119098 0.91 NTRK1 (0.58) NTRK1JAK2
SCHEMBL21319475 0.91 NTRK1 (0.50) NTRK1JAK2
SCHEMBL20119126 0.91 NTRK1 (0.58) NTRK1JAK2
SCHEMBL22151237 0.89 NTRK1 (0.56) NTRK1JAK2
SCHEMBL20795495 0.88 NTRK1 (0.60) NTRK1JAK2
SCHEMBL30480053 0.88 NTRK1 (0.60) NTRK1JAK2
SCHEMBL20795390 0.88 NTRK1 (0.60) NTRK1JAK2
SCHEMBL21319473 0.83 NTRK1 (0.57) NTRK1JAK2
SCHEMBL21319504 0.83 NTRK1 (0.57) NTRK1JAK2
SCHEMBL24168761 0.82 NTRK1 (0.65) NTRK1JAK2

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
EP-3674307-B1 MACROCYCLE CONTAINING AMINOPYRAZOLE AND PYRIMIDINE AND PHARMACEUTICAL COMPOSITION AND USE THEREOF CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2023-06-07 — — EP disclosed
US-20200291042-A1 MACROCYCLE CONTAINING AMINOPYRAZOLE AND PYRIMIDINE AND PHARMACEUTICAL COMPOSITION AND USE THEREOF LIANYUNGANG RUNZHONG PHARMACEUTICAL CO., LTD. (CN) 2020-09-17 — — US disclosed
EP-3674307-A1 MACROCYCLE CONTAINING AMINOPYRAZOLE AND PYRIMIDINE AND PHARMACEUTICAL COMPOSITION AND USE THEREOF Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2020-07-01 — — EP disclosed
WO-2019037761-A1 MACROCYCLE CONTAINING AMINOPYRAZOLE AND PYRIMIDINE AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 正大天晴药业集团股份有限公司 2019-02-28 — — 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 (1 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-20200291042-A1 MACROCYCLE CONTAINING AMINOPYRAZOLE AND PYRIMIDINE AND PHARMACEUTICAL COMPOSITION AND USE THEREOF MUSK, TK1, TYMP NTRK1 105/4885JAK2 1048/4885NTRK3 40/4885

“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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