SCHEMBL20148646

SCHEMBL20148646

COc1ccc(CN2C3CC2CN(C(C)(C)C)C3)cn1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RET P07949 17/20 0.46
CCDC6 Q16204 1/20 0.44
CRBN Q96SW2 1/20 0.44
KDR P35968 1/20 0.44
TRPV6 Q9H1D0 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41

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
SCHEMBL20148631 0.92 TRPV6 (0.47) RETCCDC6CRBNKDRTRPV6
SCHEMBL20148652 0.86 RET (0.46) RETCCDC6CRBNKDR
SCHEMBL20148641 0.85 RET (0.49) RETCCDC6CRBNKDR
SCHEMBL20148682 0.85 RET (0.48) RETCCDC6CRBNKDR
SCHEMBL18390927 0.85 RET (0.48) RETTRPV6CHRNB2CHRNA4
SCHEMBL18390929 0.83 RET (0.47) RETTRPV6CHRNB2CHRNA4
SCHEMBL20148620 0.83 RET (0.41) RETCHRNB2CHRNA4
SCHEMBL20148626 0.83 ALDH1A1 (0.45) CHRNB2CHRNA4
SCHEMBL20148666 0.83 RET (0.41) RETCCDC6CRBNKDR
SCHEMBL18713239 0.82 RET (0.48) RETCCDC6CRBNKDRTRPV6

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 1/4885CCDC6 1063/4885CRBN 283/4885
US-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885CCDC6 1063/4885CRBN 283/4885

“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.