SCHEMBL20147974

SCHEMBL20147974

CCC(=O)NC1(C)CCN(CC)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.41
EPHX1 P07099 3/20 0.38
DPP4 P27487 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRD1 P41143 2/20 0.36
OPRK1 P41145 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
EPHX2 P34913 2/20 0.35
DRD2 P14416 2/20 0.34
KDM4E B2RXH2 2/20 0.33
CYP2C9 P11712 1/20 0.33
PKM P14618 1/20 0.33
HSD11B1 P28845 1/20 0.33
MMP1 P03956 2/20 0.33
MMP9 P14780 2/20 0.33
MMP13 P45452 2/20 0.33
ADAM17 P78536 1/20 0.33
GAA P10253 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
SCHEMBL16509334 0.83 KDM4E (0.34) OPRM1OPRD1OPRK1KDM4E
SCHEMBL16306650 0.83 DRD2 (0.46) EPHX1OPRM1OPRD1OPRK1SMN1; SMN2
SCHEMBL828036 0.82
SCHEMBL25503104 0.82 DPP4 (0.35) EPHX1DPP4OPRM1OPRD1OPRK1
SCHEMBL20147475 0.79 CCR1 (0.34) CYP2D6DPP4CYP2C9MMP1MMP9
SCHEMBL18219589 0.78 ANO1 (0.36) KDM4ECYP2C9PKMGAA
SCHEMBL18793892 0.78 CYP2C9 (0.35) DPP4KDM4ECYP2C9PKM
SCHEMBL21465972 0.77 HSD11B1 (0.54) CYP2D6DPP4OPRM1OPRD1OPRK1
SCHEMBL8684589 0.76 ANO1 (0.37) DPP4SMN1; SMN2CYP2C9
SCHEMBL22857037 0.75 RET (0.37) CYP2D6EPHX1DPP4OPRM1OPRD1

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 2 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-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 (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-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 CYP2D6 3759/4885EPHX1 1481/4885DPP4 1963/4885
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 CYP2D6 3759/4885EPHX1 1481/4885DPP4 1963/4885

“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.