SCHEMBL16474196

SCHEMBL16474196

CCN1CCCC1c1cc(F)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 13/20 0.43
JAK2 O60674 11/20 0.43
RIPK1 Q13546 1/20 0.43
OPRM1 P35372 1/20 0.42

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
SCHEMBL17772161 0.90 KDM1A (0.42) NTRK1JAK2RIPK1
SCHEMBL16474299 0.85 OPRL1 (0.42) NTRK1RIPK1OPRM1
SCHEMBL28796117 0.84 NTRK1 (0.45) NTRK1JAK2OPRM1
SCHEMBL28950329 0.84 NTRK1 (0.42) NTRK1JAK2OPRM1
SCHEMBL24200617 0.84 NTRK1 (0.43) NTRK1JAK2OPRM1
SCHEMBL16474297 0.82 SLC6A2 (0.46)
SCHEMBL16474301 0.82 NTRK1 (0.46) NTRK1JAK2RIPK1OPRM1
SCHEMBL28682432 0.82 NTRK1 (0.44) NTRK1JAK2
SCHEMBL19547163 0.82 NTRK1 (0.43) NTRK1JAK2RIPK1
SCHEMBL19547185 0.81 NTRK1 (0.46) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109890820-B Aminopyrazolopyrimidine compounds as neurotrophin tyrosine kinase receptor inhibitors 正大天晴药业集团股份有限公司 2020-11-03 CN disclosed
CN-108003161-B Neurotrophic factor tyrosine kinase receptor inhibitors 正大天晴药业集团股份有限公司 2020-10-09 CN disclosed
US-10758542-B2 Substituted pyrazolo[l,5-a]pyrimidine compounds as Trk kinase inhibitors ARRAY BIOPHARMA INC. (US) 2020-09-01 US disclosed
US-10251889-B2 Substituted pyrazolo[1,5-a]pyrimidine compounds as Trk kinase inhibitors Array BioPharm Inc. (US) 2019-04-09 US disclosed
EP-2451812-B1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2017-11-08 EP disclosed
EP-2350071-B1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2014-01-08 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 (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-10251889-B2 Substituted pyrazolo[1,5-a]pyrimidine compounds as Trk kinase inhibitors TXK, FRK, LTK NTRK1 7/4885JAK2 124/4885RIPK1 319/4885
US-10758542-B2 Substituted pyrazolo[l,5-a]pyrimidine compounds as Trk kinase inhibitors LTK, TXK, FRK NTRK1 7/4885JAK2 133/4885RIPK1 304/4885

“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.