SCHEMBL20148683

SCHEMBL20148683

COc1ccc(CN2C3CC2CN(C(C)(C)C)C3)c(C)n1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RET P07949 11/20 0.36
NNMT P40261 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNA4 P43681 1/20 0.30
CCDC6 Q16204 1/20 0.30
CRBN Q96SW2 1/20 0.30
KDR P35968 1/20 0.30
PDE10A Q9Y233 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
SCHEMBL20148650 0.88 RET (0.44) RET
SCHEMBL22031278 0.86 RET (0.34) RETNNMTCHRNB2CHRNA4PDE10A
SCHEMBL20070794 0.82 PDE10A (0.34) RETNNMTCHRNB2CHRNA4PDE10A
SCHEMBL22812097 0.82 PDE10A (0.33) RETNNMTCHRNB2CHRNA4PDE10A
SCHEMBL20148628 0.79 RET (0.43) RET
SCHEMBL20148654 0.77 RET (0.47) RETNNMTCCDC6CRBNKDR
SCHEMBL20148646 0.76 RET (0.46) RETCHRNB2CHRNA4CCDC6CRBN
SCHEMBL21158877 0.73 RET (0.42) RETCHRNB2CHRNA4
SCHEMBL20148679 0.72 RET (0.43) RETCHRNB2CHRNA4CCDC6CRBN
SCHEMBL20148680 0.71 RET (0.41) RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
US-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
US-20180134702-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
US-20180134702-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 (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-20180134702-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885NNMT 2639/4885CHRNB2 2276/4885
US-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885NNMT 2639/4885CHRNB2 2276/4885

“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.