SCHEMBL20153143

SCHEMBL20153143

CCCC1(C)CN(C(C)=O)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
POLB P06746 1/20 0.38
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PIK3CD O00329 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NOTUM Q6P988 1/20 0.31
KMT2A Q03164 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30
CHRNB3 Q05901 1/20 0.30
CHRNA6 Q15825 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
SCHEMBL26620413 0.82 SMN1; SMN2 (0.50) SMN1; SMN2POLBALDH1A1CYP1A2TDP1
SCHEMBL14818671 0.80 SMN1; SMN2 (0.43) SMN1; SMN2POLBALDH1A1CYP1A2TDP1
SCHEMBL22758461 0.79 CYP1A2 (0.40) SMN1; SMN2ALDH1A1CYP1A2TDP1PIK3CD
SCHEMBL20738498 0.77 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1CYP1A2TDP1PIK3CD
SCHEMBL25500305 0.75 POLB (0.40) POLBALDH1A1
SCHEMBL23231030 0.74 USP2 (0.42) SMN1; SMN2ALDH1A1
SCHEMBL24811738 0.72 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1CYP1A2TDP1PIK3CD
SCHEMBL24615831 0.72 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1CYP1A2TDP1PIK3CD
SCHEMBL20148575 0.72 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1CYP1A2TDP1PIK3CD
SCHEMBL22350693 0.72 SMN1; SMN2 (0.37) SMN1; SMN2POLBCYP1A2TDP1KMT2A

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-20180133200-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 (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-20180133200-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF SMN1; SMN2 833/4885POLB 3678/4885ALDH1A1 2868/4885

“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.