SCHEMBL20158876

SCHEMBL20158876

CCC(C)N1CCC(C)(NC(=O)c2cc(C#N)ccc2C)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RET P07949 15/20 0.46
MCHR1 Q99705 1/20 0.41
HRH3 Q9Y5N1 1/20 0.39
EGLN1 Q9GZT9 1/20 0.38
CXCR5 P32302 1/20 0.37
F9 P00740 1/20 0.37

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
SCHEMBL20147561 0.89 RET (0.45) RETMCHR1EGLN1CXCR5F9
SCHEMBL20068926 0.83 RET (0.46) RETMCHR1EGLN1CXCR5F9
SCHEMBL25503766 0.75 P2RX7 (0.43) RETMCHR1
SCHEMBL20147579 0.72 F10 (0.41) RET
SCHEMBL20147539 0.72 RET (0.46) RET
SCHEMBL20068929 0.71 MAPT (0.45) RETMCHR1CXCR5
SCHEMBL20068953 0.69 P2RX7 (0.47)
SCHEMBL20152062 0.68 RET (0.42) RET
SCHEMBL25503767 0.68 MCHR1 (0.47) RETMCHR1
SCHEMBL21651991 0.68 CCR3 (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-20180134703-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-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885MCHR1 1063/4885HRH3 1000/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885MCHR1 1063/4885HRH3 1000/4885

“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.