SCHEMBL20965459

SCHEMBL20965459

CSN1CCN(C(=O)N2CCC(c3ccccc3)C2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.58
HRH3 Q9Y5N1 1/20 0.58
RAB9A P51151 10/20 0.52
NPC1 O15118 8/20 0.52
SMN1; SMN2 Q16637 7/20 0.52
TP53 P04637 4/20 0.52
ALDH1A1 P00352 3/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 6/20 0.50
ATM Q13315 1/20 0.50
HPGD P15428 1/20 0.50
NFKB1 P19838 2/20 0.47
NFKB2 Q00653 2/20 0.47
RELA Q04206 2/20 0.47
LMNA P02545 2/20 0.47
HTT P42858 1/20 0.47
STAT1 P42224 1/20 0.47
TSHR P16473 1/20 0.47
HSD11B1 P28845 3/20 0.46
LIPE Q05469 1/20 0.46

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
SCHEMBL27842786 0.85 RAB9A (0.67) KCNH2HRH3RAB9ANPC1SMN1; SMN2
SCHEMBL18390882 0.85 KCNH2 (0.62) KCNH2HRH3RAB9ANPC1SMN1; SMN2
SCHEMBL18390868 0.81 HRH3 (0.58) KCNH2HRH3RAB9ANPC1SMN1; SMN2
SCHEMBL18704935 0.81 HRH3 (0.87) KCNH2HRH3RAB9ANPC1SMN1; SMN2
SCHEMBL27888979 0.79 KCNH2 (0.73) KCNH2HRH3RAB9ANPC1SMN1; SMN2
SCHEMBL27878990 0.78 ALDH1A1 (0.62) RAB9ANPC1SMN1; SMN2TP53ALDH1A1
SCHEMBL21992389 0.77 DRD2 (0.47) RAB9ANPC1SMN1; SMN2TP53ALDH1A1
SCHEMBL18633798 0.77 DRD2 (0.55) SMN1; SMN2TSHR
SCHEMBL20349507 0.77 KCNH2 (0.62) KCNH2HRH3RAB9ANPC1SMN1; SMN2
SCHEMBL1197270 0.76 RAB9A (0.63) KCNH2HRH3RAB9ANPC1SMN1; SMN2

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-20190127373-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2019-05-02 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-20190127373-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF KCNH2 4007/4885HRH3 1340/4885RAB9A 885/4885

“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.