SCHEMBL25501874

SCHEMBL25501874

CCC(C)N1CCC(CN2CCN(CC)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.38
CHRM5 P08912 1/20 0.35
ADRA2C P18825 1/20 0.35
ACHE P22303 1/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
HSD11B1 P28845 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CACNA2D1 P54289 1/20 0.31
CACNA1B Q00975 1/20 0.31
CACNB1 Q02641 1/20 0.31
CACNA1C Q13936 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
SCHEMBL18713117 0.87 KDM4E (0.40) HRH3CHRM5ADRA2CACHEKDM4E
SCHEMBL26143684 0.85 CHRM5 (0.38) HRH3CHRM5ADRA2CACHEKDM4E
SCHEMBL23133620 0.83 THRB (0.39) HRH3CHRM5ADRA2CACHEALDH1A1
SCHEMBL24723848 0.82 CHRM5 (0.53) CHRM5ADRA2CACHEKDM4EALDH1A1
SCHEMBL12850091 0.80 KDM4E (0.37) HRH3KDM4EALDH1A1SMN1; SMN2
SCHEMBL22520700 0.80 ACHE (0.50) HRH3CHRM5ADRA2CACHEKDM4E
SCHEMBL26480974 0.80 ACHE (0.50) HRH3CHRM5ADRA2CACHEKDM4E
SCHEMBL24294565 0.80 ACHE (0.40) HRH3CHRM5ADRA2CACHEKDM4E
SCHEMBL21158999 0.79 KDM4E (0.36) CHRM5ADRA2CACHEKDM4EALDH1A1
SCHEMBL25759060 0.79 KDM4E (0.39) HRH3CHRM5ADRA2CACHEKDM4E

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 HRH3 1000/4885CHRM5 2607/4885ADRA2C 3439/4885

“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.