SCHEMBL19823080

SCHEMBL19823080

COC(=O)[C@@H]1CC[C@@](O)(c2cc(C)cc(Nc3cc(C)[nH]n3)n2)C1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RET P07949 13/20 0.50
AURKA O14965 3/20 0.37
AURKB Q96GD4 3/20 0.37
SYK P43405 3/20 0.37

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
SCHEMBL19363854 0.92 RET (0.45) RETAURKAAURKB
SCHEMBL19823168 0.90 RET (0.51) RETAURKAAURKBSYK
SCHEMBL19813620 0.90 RET (0.51) RETAURKAAURKBSYK
SCHEMBL18789241 0.85 RET (0.55) RETAURKAAURKBSYK
SCHEMBL18789278 0.85 RET (0.55) RETAURKAAURKBSYK
SCHEMBL30401442 0.85 RET (0.55) RETAURKAAURKBSYK
SCHEMBL18789285 0.85 RET (0.51) RETAURKAAURKBSYK
SCHEMBL18789286 0.85 RET (0.51) RETAURKAAURKBSYK
SCHEMBL29969423 0.85 RET (0.54) RETAURKAAURKBSYK
SCHEMBL19349943 0.83 RET (0.46) RETAURKAAURKBSYK

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-10035789-B2 Compounds useful for treating disorders related to RET BLUEPRINT MEDICINES CORPORATION (US) 2018-07-31 US disclosed
WO-2018022761-A1 SUBSTITUTED CYCLOPENTANE-AMIDES FOR TREATING DISORDERS RELATED TO RET BLUEPRINT MEDICINES CORPORATION (US) 2018-02-01 WO disclosed
US-20180030032-A1 COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO RET BLUEPRINT MEDICINES CORPORATION 2018-02-01 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-10035789-B2 Compounds useful for treating disorders related to RET RET, EYA2, HRAS RET 1/4885AURKA 4348/4885AURKB 3696/4885
US-20180030032-A1 COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO RET RET, EYA2, HRAS RET 1/4885AURKA 4348/4885AURKB 3696/4885

“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.