SCHEMBL24159345

SCHEMBL24159345

CC(Nc1ccn2ncc(I)c2n1)c1cc(F)ccc1OCCF

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 20/20 0.57
▸ NTRK3 Q16288 8/20 0.57
▸ NTRK2 Q16620 6/20 0.49

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
SCHEMBL22454740 1.00 NTRK1 (0.57) NTRK1NTRK3NTRK2
SCHEMBL22454712 0.95 NTRK1 (0.56) NTRK1NTRK3NTRK2
SCHEMBL24503147 0.94 NTRK1 (0.61) NTRK1NTRK3NTRK2
SCHEMBL22454508 0.93 NTRK1 (0.59) NTRK1NTRK3NTRK2
SCHEMBL22454473 0.93 NTRK1 (0.57) NTRK1NTRK3NTRK2
SCHEMBL22454736 0.92 NTRK1 (0.56) NTRK1NTRK3NTRK2
SCHEMBL22454686 0.91 NTRK1 (0.59) NTRK1NTRK3NTRK2
SCHEMBL22454667 0.89 NTRK1 (0.71) NTRK1NTRK3NTRK2
SCHEMBL22454816 0.89 NTRK1 (0.71) NTRK1NTRK3NTRK2
SCHEMBL29684109 0.89 NTRK1 (0.71) 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
EP-3932923-B1 PYRAZOLOPYRIMIDINE COMPOUND, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREFOR UNIV CENTRAL CHINA NORMAL (CN) 2023-05-03 — — EP disclosed
US-20220177477-A1 PYRAZOLOPYRIMIDINE COMPOUND, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREFOR Central China Normal University (CN) 2022-06-09 — — US disclosed
EP-3932923-A1 PYRAZOLOPYRIMIDINE COMPOUND, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREFOR Central China Normal University (CN) 2022-01-05 — — EP 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-20220177477-A1 PYRAZOLOPYRIMIDINE COMPOUND, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREFOR ITK, TKFC, WEE2 NTRK1 25/4885NTRK3 14/4885NTRK2 96/4885

“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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