SCHEMBL25504102

SCHEMBL25504102

C[SH](S)N1CCC(CO)(NC(=O)c2ncccc2F)CC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RET P07949 6/20 0.45
GRM5 P41594 1/20 0.38
NTRK1 P04629 3/20 0.37
CTSA P10619 2/20 0.36
CNR2 P34972 5/20 0.35
CNR1 P21554 2/20 0.34
PTPN11 Q06124 1/20 0.34

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
SCHEMBL20069182 0.85 RET (0.48) RETGRM5NTRK1CTSACNR2
SCHEMBL20147623 0.83 RET (0.46) RETGRM5NTRK1CTSACNR2
SCHEMBL20069611 0.75 RET (0.49) RETGRM5CTSAPTPN11
SCHEMBL25504259 0.73 RET (0.47) RETGRM5CTSAPTPN11
SCHEMBL20147659 0.72 RET (0.48) RETGRM5CTSA
SCHEMBL20069179 0.72 RET (0.48) RETNTRK1CNR2PTPN11
SCHEMBL20069773 0.70 RET (0.44) RETGRM5CTSAPTPN11
SCHEMBL20147620 0.70 RET (0.46) RET
SCHEMBL21652054 0.68 RET (0.43) RETGRM5CTSAPTPN11
SCHEMBL20147644 0.68 RET (0.42) RETGRM5CTSAPTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-05-16 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 (1 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-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885GRM5 1363/4885NTRK1 381/4885

“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.