SCHEMBL22857058

SCHEMBL22857058

CCC(C)N1CCC(CNC(=O)CC(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
RET P07949 2/20 0.38
PREP P48147 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
PIK3CA P42336 1/20 0.36
MTOR P42345 1/20 0.36
KCNH2 Q12809 2/20 0.36
CACNA1I Q9P0X4 2/20 0.36
GAK O14976 1/20 0.35
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN5 P54829 1/20 0.33
PTPN11 Q06124 1/20 0.33
CCR1 P32246 1/20 0.33

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
SCHEMBL20069186 0.87 SMN1; SMN2 (0.42) SMN1; SMN2TP53RETPREPNFKB1
SCHEMBL12413709 0.81 SMN1; SMN2 (0.47) SMN1; SMN2TP53RETPREPNFKB1
SCHEMBL20147955 0.80 TP53 (0.44) SMN1; SMN2TP53RETPREPNFKB1
SCHEMBL16906899 0.77 CKS1B (0.39) SMN1; SMN2KCNH2CACNA1ILMNAHTT
SCHEMBL22519427 0.76 SMN1; SMN2 (0.49) SMN1; SMN2TP53PREPNFKB1NFKB2
SCHEMBL24713145 0.76 LMNA (0.34) SMN1; SMN2LMNAHTTALDH1A1MAPT
SCHEMBL4515125 0.75 TDP1 (0.48) SMN1; SMN2TP53PREPNFKB1NFKB2
SCHEMBL21725302 0.72 LMNA (0.31) SMN1; SMN2LMNAHTTALDH1A1MAPT
SCHEMBL11890389 0.72 EPHX1 (0.48) SMN1; SMN2TP53PREPHPGD
SCHEMBL9575 0.71 EPHX1 (0.52) SMN1; SMN2ALDH1A1HPGD

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-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 (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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 SMN1; SMN2 646/4885TP53 759/4885RET 1/4885

“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.