SCHEMBL20148689

SCHEMBL20148689

CN(C)c1ncc(CN2C3CC2CN(C(C)(C)C)C3)s1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.43
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
PDE2A O00408 1/20 0.37
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
DNM1L O00429 1/20 0.32

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
SCHEMBL20071345 0.85 RET (0.41) RETKMT2AMEN1PDE2AALDH1A1
SCHEMBL20149623 0.82 RET (0.40) RETKMT2AMEN1PDE2AALDH1A1
SCHEMBL20148672 0.80 RET (0.44) RETKMT2AMEN1ALDH1A1LMNA
SCHEMBL20154603 0.79 RET (0.40) RETKMT2AMEN1PDE2AALDH1A1
SCHEMBL20148690 0.72 RET (0.44) RET
SCHEMBL20148640 0.69 RET (0.36) RET
SCHEMBL20148686 0.69 RET (0.39) RET
SCHEMBL20148695 0.68 RET (0.40) RET
SCHEMBL20148666 0.67 RET (0.41) RET
SCHEMBL20148681 0.67 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 3 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-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 1/4885KMT2A 1171/4885MEN1 680/4885
US-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885KMT2A 1171/4885MEN1 680/4885

“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.