SCHEMBL20153225

SCHEMBL20153225

COc1ccc(N2C3CC2CN(C)C3)cn1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 0.52
CHRNA4 P43681 5/20 0.52
CHRNB4 P30926 3/20 0.46
CHRNA3 P32297 3/20 0.46
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
RET P07949 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
OXTR P30559 5/20 0.39
AVPR1A P37288 3/20 0.36
AVPR2 P30518 1/20 0.36
OGA O60502 1/20 0.35

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
SCHEMBL20149644 0.84 CHRNB2 (0.49) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL20070478 0.84 CHRNB2 (0.49) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL23555019 0.84 CHRNB2 (0.49) CHRNB2CHRNA4CHRNB4CHRNA3RET
SCHEMBL22811911 0.84 CHRNB2 (0.49) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL20153227 0.80 CHRNB2 (0.45) CHRNB2CHRNA4CHRNB4CHRNA3RET
SCHEMBL23126264 0.80 CHRNB2 (0.45) CHRNB2CHRNA4CHRNB4CHRNA3RET
SCHEMBL22041916 0.78 RET (0.47) CHRNB2CHRNA4CHRNB4CHRNA3RET
SCHEMBL30359559 0.78 RET (0.47) CHRNB2CHRNA4CHRNB4CHRNA3RET
SCHEMBL20071394 0.77 CHRNB2 (0.43) CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2
SCHEMBL21695480 0.77 CHRNB2 (0.60) CHRNB2CHRNA4CHRNB4CHRNA3RET

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-3753939-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS Array Biopharma Inc. (US) 2020-12-23 EP disclosed
EP-3523301-B1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-05-27 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 CHRNB2 2276/4885CHRNA4 1977/4885CHRNB4 1708/4885

“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.