SCHEMBL22857016

SCHEMBL22857016

CN1CCC(C)(NC(=O)C2(N)CCOCC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.37
CTSS P25774 1/20 0.33
CTSC P53634 4/20 0.32
CTSK P43235 1/20 0.32
KCNH2 Q12809 1/20 0.30
LTB4R Q15722 1/20 0.30
LTB4R2 Q9NPC1 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
ALOX12 P18054 1/20 0.30

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
SCHEMBL20205769 0.89 RET (0.33) RET
SCHEMBL20068845 0.85 RET (0.35) RET
SCHEMBL20206064 0.84 RET (0.40) RETCTSCCTSKKCNH2LTB4R
SCHEMBL20069014 0.84 RET (0.36) RETCTSCKCNH2LTB4RLTB4R2
SCHEMBL20068840 0.73 SCN1A (0.33) RET
SCHEMBL20069012 0.73 RET (0.44) RETCTSSCTSK
SCHEMBL20069071 0.71 SCN1A (0.35) RET
SCHEMBL20070401 0.71 CYP2D6 (0.34) RETHRH3
SCHEMBL17749033 0.70 OPRM1 (0.36) KCNH2
SCHEMBL13103020 0.70 DRD2 (0.40)

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-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-05-16 US disclosed
US-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-01-05 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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885CTSS 4551/4885CTSC 3852/4885
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885CTSS 4551/4885CTSC 3852/4885

“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.