SCHEMBL20153259

SCHEMBL20153259

CN1CC2CC(C1)N2Cc1ccn(C)c(=O)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.40
SIGMAR1 Q99720 1/20 0.34
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
HSD11B1 P28845 1/20 0.31
PIK3C3 Q8NEB9 1/20 0.30

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
SCHEMBL20148730 0.86 RET (0.38) RETSIGMAR1CHRM2CHRM4CHRM5
SCHEMBL21159008 0.86 RET (0.42) RETSIGMAR1CHRM2CHRM4CHRM5
SCHEMBL18390147 0.73 CHRM2 (0.58) SIGMAR1CHRM2CHRM4CHRM5
SCHEMBL18713014 0.72 MC4R (0.51)
SCHEMBL22812251 0.71 RET (0.41) RETSIGMAR1HSD11B1
SCHEMBL22031260 0.71 RET (0.44) RETSIGMAR1CHRM2CHRM4CHRM5
SCHEMBL20070752 0.70 RET (0.35) RETHSD11B1
SCHEMBL20635782 0.70 RET (0.35) RET
SCHEMBL21159000 0.70 SIGMAR1 (0.45) RETSIGMAR1
SCHEMBL20154485 0.69 RET (0.40) RETSIGMAR1CHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3753939-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS Array Biopharma Inc. (US) 2020-12-23 EP disclosed
US-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 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-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885SIGMAR1 3863/4885CHRM2 3260/4885

“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.