SCHEMBL26041581

SCHEMBL26041581

CC(C)(C)OC(=O)N1CCN2C(=O)c3cc(F)c(Br)c(Cl)c3OCC2C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KRAS P01116 3/20 0.40
HDAC6 Q9UBN7 1/20 0.39
USP30 Q70CQ3 4/20 0.37
TP53 P04637 1/20 0.36
FPR2 P25090 2/20 0.35
GPR119 Q8TDV5 3/20 0.34
SMARCA2 P51531 1/20 0.34
SMARCA4 P51532 1/20 0.34
PBRM1 Q86U86 1/20 0.34
SCN9A Q15858 1/20 0.33
IDO1 P14902 1/20 0.33
PAK1 Q13153 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP3A5 P20815 1/20 0.33
DPP4 P27487 1/20 0.32

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
SCHEMBL29693105 1.00 KRAS (0.40) KRASHDAC6USP30TP53FPR2
SCHEMBL23512813 1.00 KRAS (0.40) KRASHDAC6USP30TP53FPR2
SCHEMBL23513061 0.91 USP30 (0.42) HDAC6USP30TP53FPR2GPR119
SCHEMBL23512532 0.91 USP30 (0.42) HDAC6USP30TP53FPR2GPR119
SCHEMBL24558315 0.91 KRAS (0.40) KRASHDAC6USP30TP53FPR2
SCHEMBL29693256 0.91 KRAS (0.41) KRASHDAC6USP30TP53FPR2
SCHEMBL24558112 0.91 KRAS (0.41) KRASHDAC6USP30TP53FPR2
SCHEMBL24558102 0.89 KRAS (0.41) KRASHDAC6USP30TP53FPR2
SCHEMBL23512988 0.89 KRAS (0.40) KRASHDAC6USP30TP53GPR119
SCHEMBL23512593 0.89 KRAS (0.40) KRASHDAC6USP30TP53GPR119

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
EP-3935060-B1 FUSED TRICYCLIC COMPOUNDS USEFUL AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2023-11-15 EP disclosed
US-20230339968-A1 KRAS Gl2C INHIBITORS ELI LILLY AND COMPANY 2023-10-26 US disclosed
US-11731984-B2 KRas G12C inhibitors ELI LILLY AND COMPANY (US) 2023-08-22 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-20230339968-A1 KRAS Gl2C INHIBITORS KRAS, NRAS, GLS2 KRAS 1/4885HDAC6 1340/4885USP30 3416/4885
US-11731984-B2 KRas G12C inhibitors KRAS, NRAS, HRAS KRAS 1/4885HDAC6 1738/4885USP30 2637/4885

“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.