SCHEMBL20070142

SCHEMBL20070142

CN(C)CCOC1CN(C)CCC1NC(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.45
ACACB O00763 3/20 0.39
ACACA Q13085 3/20 0.39
CTSK P43235 2/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CYP2C9 P11712 1/20 0.35
HSD11B1 P28845 1/20 0.35
DRD2 P14416 2/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
SSTR4 P31391 3/20 0.33
SSTR1 P30872 2/20 0.33
CCR5 P51681 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
SCHEMBL20147499 0.85 RET (0.43) RETACACBACACACTSKCA1
SCHEMBL20069527 0.80 CTSK (0.44) RETCTSKCA1CA2CYP2C9
SCHEMBL19918869 0.80 CTSK (0.44) RETCTSKCA1CA2CYP2C9
SCHEMBL12135069 0.80 CTSK (0.44) RETCTSKCA1CA2CYP2C9
SCHEMBL24854857 0.74 CTSK (0.46) RETCTSKCA1CA2CYP2C9
SCHEMBL19465291 0.74 CTSK (0.46) RETCTSKCA1CA2CYP2C9
SCHEMBL20070141 0.74 CTSK (0.46) RETCTSKCA1CA2CYP2C9
SCHEMBL25145157 0.74 CTSK (0.41) CTSKCA1CA2CYP2C9HSD11B1
SCHEMBL10170694 0.74 MEN1 (0.43) RETCTSKCA1CA2CYP2C9
SCHEMBL28826192 0.73 SSTR4 (0.47) CTSKCA1CA2CYP2C9HSD11B1

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-20200383966-A9 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-12-10 US disclosed
US-20200030311-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2020-01-30 US disclosed
WO-2018071454-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO 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 (2 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-20200383966-A9 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885ACACB 4835/4885ACACA 4789/4885
US-20200030311-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885ACACB 4835/4885ACACA 4789/4885

“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.