SCHEMBL20154477

SCHEMBL20154477

CCN1CC2CC(C1)N2Cc1ccc(N(C)C)nc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RET P07949 7/20 0.41
CHRM1 P11229 1/20 0.35
PDE9A O76083 1/20 0.35
HDAC6 Q9UBN7 1/20 0.33
HPGDS O60760 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL22031262 0.86 RET (0.42) RETCHRM1PDE9AHDAC6
SCHEMBL20148690 0.83 RET (0.44) RETCHRM1PDE9AHDAC6HPGDS
SCHEMBL20070777 0.83 RET (0.40) RETCHRM1PDE9AHDAC6
SCHEMBL22031263 0.83 RET (0.40) RETCHRM1PDE9AHDAC6
SCHEMBL23126262 0.81 CYP11B1 (0.40) RET
SCHEMBL20154478 0.79 RET (0.42) RET
SCHEMBL18390929 0.79 RET (0.47) RET
SCHEMBL18390322 0.77 ALDH1A1 (0.51) RETKMT2A
SCHEMBL18713233 0.74 CHRNB2 (0.49) RET
SCHEMBL22030585 0.71 RET (0.46) 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-10172851-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-20180133213-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-10172851-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, ROR1, BRAF RET 1/4885CHRM1 2284/4885PDE9A 791/4885
US-20180133213-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885CHRM1 2284/4885PDE9A 791/4885

“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.