SCHEMBL24859641

SCHEMBL24859641

COCC1CN(C(C)S)CCO1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 6/20 0.49
HRH3 Q9Y5N1 4/20 0.47
DRD4 P21917 7/20 0.33
LRRK2 Q5S007 2/20 0.31
ERBB2 P04626 1/20 0.31
EPHA2 P29317 1/20 0.31
KDR P35968 1/20 0.31
EPHB4 P54760 1/20 0.31

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
SCHEMBL17212814 0.86 HRH3 (0.60) PDK1HRH3DRD4ERBB2EPHA2
SCHEMBL12110193 0.86 HRH3 (0.60) PDK1HRH3DRD4ERBB2EPHA2
SCHEMBL21166008 0.86 HRH3 (0.60) PDK1HRH3DRD4ERBB2EPHA2
SCHEMBL25931855 0.81 HRH3 (0.40) PDK1HRH3
SCHEMBL20624866 0.79 PDK1 (0.45) PDK1HRH3
SCHEMBL23467615 0.79 PDK1 (0.45) PDK1HRH3
SCHEMBL27571505 0.79 PDK1 (0.51) PDK1HRH3DRD4
SCHEMBL24498621 0.77 HRH3 (0.38) HRH3
SCHEMBL23707123 0.76 HRH3 (0.50) PDK1HRH3DRD4ERBB2EPHA2
SCHEMBL23467616 0.75 HRH3 (0.49) PDK1HRH3DRD4ERBB2EPHA2

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-11548890-B1 HPK1 antagonists and uses thereof Nimbus Saturn, Inc. (US) 2023-01-10 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-11548890-B1 HPK1 antagonists and uses thereof PDXK, HIPK1, PCK1 PDK1 185/4885HRH3 387/4885DRD4 4878/4885

“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.