SCHEMBL20069719

SCHEMBL20069719

CN(C)CC1(NC(=O)CC2CC2)CCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.41
EPHX1 P07099 2/20 0.37
KEAP1 Q14145 2/20 0.33
NFE2L2 Q16236 2/20 0.33
NAMPT P43490 1/20 0.33
SMYD3 Q9H7B4 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ENPP1 P22413 1/20 0.31
CTSL P07711 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30
GNAI3 P08754 1/20 0.30
GNAO1 P09471 1/20 0.30
GNAI1 P63096 1/20 0.30
ADAM17 P78536 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
SCHEMBL20147496 0.85 RET (0.40) RETEPHX1NAMPTOPRM1OPRL1
SCHEMBL20147918 0.84 RET (0.39) RETEPHX1NAMPT
SCHEMBL20069722 0.81 RET (0.43) RET
SCHEMBL20069525 0.78 RET (0.41) RETNAMPTADAM17
SCHEMBL20069706 0.78 EPHX1 (0.50) RETEPHX1KEAP1NFE2L2NAMPT
SCHEMBL20069520 0.77 RET (0.43) RETEPHX1KDM4ECTSLCTSS
SCHEMBL20069708 0.75 RET (0.43) RETADAM17
SCHEMBL20158431 0.74 RET (0.39) RETKDM4ECTSLCTSS
SCHEMBL20069711 0.72 RET (0.40) RET
SCHEMBL20148067 0.72 RET (0.40) RETKDM4ECTSLCTSS

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-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 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-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885EPHX1 1481/4885KEAP1 1795/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885EPHX1 1481/4885KEAP1 1795/4885

“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.