SCHEMBL25503136

SCHEMBL25503136

CCN1CCN(CC2(NC(=O)CC(C)(C)C)CCN(C)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.33
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
RET P07949 4/20 0.31
KCNQ2 O43526 1/20 0.31
HSD11B1 P28845 2/20 0.31
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
CACNA1H O95180 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
SCHEMBL20201375 0.86 SIGMAR1 (0.36) EPHX1KDM4EMEN1CYP1A2CYP3A4
SCHEMBL25503147 0.84 RET (0.32) EPHX1RET
SCHEMBL20069716 0.81 RET (0.43) EPHX1KDM4ERETSIGMAR1
SCHEMBL20069706 0.81 EPHX1 (0.50) EPHX1KDM4EPKMRETHSD11B1
SCHEMBL20069700 0.80 CACNA1H (0.37) RETSIGMAR1CACNA1H
SCHEMBL20069705 0.79 RET (0.41) EPHX1KDM4EMEN1KMT2ARET
SCHEMBL20069696 0.78 RET (0.41) EPHX1KDM4EPKMMEN1CYP2C19
SCHEMBL20069697 0.77 RET (0.43) RET
SCHEMBL20070369 0.76 RET (0.44) KDM4EMEN1KMT2ARET
SCHEMBL20069726 0.76 RET (0.42) EPHX1KDM4EMEN1CYP2C19KMT2A

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-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-05-16 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-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 EPHX1 1481/4885KDM4E 547/4885PKM 1352/4885

“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.