SCHEMBL20160448

SCHEMBL20160448

CN1CC2CC(C1)N2C(=O)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
CHRNB2 P17787 9/20 0.39
CHRNA3 P32297 9/20 0.39
CHRNA4 P43681 9/20 0.39
CHRNB3 Q05901 4/20 0.39
CHRNA6 Q15825 4/20 0.39
HTT P42858 1/20 0.39
CNR1 P21554 1/20 0.39
RECQL P46063 1/20 0.38
CHRNB4 P30926 5/20 0.36
CHRNA7 P36544 5/20 0.36
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
LMNA P02545 1/20 0.34
JAK2 O60674 2/20 0.34
JAK1 P23458 2/20 0.34
TYK2 P29597 2/20 0.34

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
SCHEMBL20071309 0.93 MAPT (0.41) MAPTCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL21695514 0.92 RECQL (0.48) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL20071307 0.92 RECQL (0.48) MAPTCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL20071305 0.90 RECQL (0.52) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL13265396 0.89 MAPT (0.43) MAPTCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL20160445 0.88 RET (0.35) MAPTCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL22031247 0.87 PIK3CD (0.44) MAPTCNR1RECQLTSHRLMNA
SCHEMBL20153125 0.86 RET (0.35) MAPTCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL20071314 0.81 APLNR (0.41) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL21158721 0.81 PIK3CD (0.36) CNR1

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-20180134702-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-20180134702-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF MAPT 1769/4885CHRNB2 2276/4885CHRNA3 1700/4885

“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.