SCHEMBL24200523

SCHEMBL24200523

C=Nc1ccc(N2C[C@@H](F)C[C@@H]2c2cc(F)ccc2F)nc1/C(=C\C)NS(=O)(=O)N1CCC(O[Si](C)(C)C(C)(C)C)C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 20/20 0.32
JAK2 O60674 5/20 0.31

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
SCHEMBL22013154 0.77 NTRK1 (0.33) NTRK1JAK2
SCHEMBL24200659 0.73 NTRK1 (0.43) NTRK1JAK2
SCHEMBL24200637 0.66 NTRK1 (0.38) NTRK1JAK2
SCHEMBL24200521 0.66 NTRK1 (0.34) NTRK1JAK2
SCHEMBL24200666 0.66 NTRK1 (0.37) NTRK1JAK2
SCHEMBL24200681 0.65 NTRK1 (0.40) NTRK1JAK2
SCHEMBL24200729 0.64 NTRK1 (0.36) NTRK1JAK2
SCHEMBL24200630 0.63 NTRK1 (0.52) NTRK1JAK2
SCHEMBL22013130 0.63 NTRK1 (0.39) NTRK1JAK2
SCHEMBL28605193 0.63 NTRK1 (0.39) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220017512-A1 SIX-MEMBERED AND SIX-MEMBERED HETEROCYCLIC COMPOUND AND USES THEREOF SERVING AS PROTEIN RECEPTOR KINASE INHIBITOR SHANGHAI ENNOVABIO PHARMACEUTICALS CO., LTD. (CN) 2022-01-20 US 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-20220017512-A1 SIX-MEMBERED AND SIX-MEMBERED HETEROCYCLIC COMPOUND AND USES THEREOF SERVING AS PROTEIN RECEPTOR KINASE INHIBITOR GRK6, ERBB2, ERBB3 NTRK1 40/4885JAK2 344/4885

“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.