SCHEMBL20147955

SCHEMBL20147955

CCN1CCC(CNC(=O)CC(C)C)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
DRD2 P14416 2/20 0.42
DRD3 P35462 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPK1 P28482 1/20 0.42
EPHX1 P07099 2/20 0.42
EPHX2 P34913 1/20 0.42
MEN1 O00255 1/20 0.42
PMP22 Q01453 1/20 0.42
KMT2A Q03164 1/20 0.42
PREP P48147 1/20 0.39
KCNH2 Q12809 1/20 0.38
CACNA1I Q9P0X4 1/20 0.38
RET P07949 2/20 0.37
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL12413709 0.83 SMN1; SMN2 (0.47) TP53SMN1; SMN2DRD2DRD3CYP1A2
SCHEMBL16771662 0.82 TP53 (0.46) TP53SMN1; SMN2DRD2DRD3CYP1A2
SCHEMBL20069186 0.81 SMN1; SMN2 (0.42) TP53SMN1; SMN2PREPKCNH2CACNA1I
SCHEMBL22857058 0.80 SMN1; SMN2 (0.39) TP53SMN1; SMN2PREPKCNH2CACNA1I
SCHEMBL14155743 0.80 EPHX1 (0.47) TP53SMN1; SMN2DRD2DRD3CYP1A2
SCHEMBL13572434 0.80 EPHX1 (0.47) TP53SMN1; SMN2DRD2DRD3CYP1A2
SCHEMBL23709501 0.79 KCNH2 (0.40) TP53DRD2DRD3CYP1A2CYP3A4
SCHEMBL22519427 0.78 SMN1; SMN2 (0.49) TP53SMN1; SMN2PREPKCNH2CACNA1I
SCHEMBL4515125 0.77 TDP1 (0.48) TP53SMN1; SMN2CYP3A4PREPPIK3CA
SCHEMBL22169742 0.77 EPHX1 (0.45) TP53SMN1; SMN2DRD2DRD3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-10-15 US disclosed
US-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-31 US disclosed
US-20180133207-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 (3 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-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 TP53 759/4885SMN1; SMN2 646/4885DRD2 3425/4885
US-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 TP53 759/4885SMN1; SMN2 646/4885DRD2 3425/4885
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 TP53 759/4885SMN1; SMN2 646/4885DRD2 3425/4885

“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.