SCHEMBL22856992

SCHEMBL22856992

CC1(NC(=O)OC(C)(C)C)CCN(SS)CC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.34
RET P07949 5/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
CTSK P43235 2/20 0.31
DRD2 P14416 2/20 0.31
HCRTR2 O43614 1/20 0.31
GAA P10253 1/20 0.31
EPHX2 P34913 1/20 0.31
CACNA1H O95180 1/20 0.30
CTSL P07711 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
SCHEMBL20158650 0.89 RET (0.38) RET
SCHEMBL20158649 0.87 RET (0.40) RET
SCHEMBL25985026 0.86 RORC (0.35) RORCRETMEN1MAPK1KMT2A
SCHEMBL12440624 0.81 RORC (0.37) RORCRETMEN1MAPK1KMT2A
SCHEMBL2087734 0.80 RORC (0.43) RORCMEN1MAPK1KMT2ACTSK
SCHEMBL20152043 0.80 RORC (0.36) RORCRETMEN1MAPK1KMT2A
SCHEMBL20975988 0.78 DRD2 (0.40) RORCRETMEN1MAPK1KMT2A
SCHEMBL21410530 0.78 RORC (0.38) RORCRETMEN1MAPK1KMT2A
SCHEMBL1994522 0.78 USP2 (0.47) EPHX2
SCHEMBL16887631 0.78 CYP4F2 (0.40) RORCRETMEN1MAPK1KMT2A

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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-01-05 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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RORC 440/4885RET 1/4885MEN1 653/4885

“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.