SCHEMBL30776563

SCHEMBL30776563

CC(C)(C)OC(=O)Nc1sc2c(F)ccc(-c3c4c(c5ccc(OCCO)nc5c3Cl)COC4)c2c1C#N

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.32
KRAS P01116 1/20 0.32
POLB P06746 3/20 0.32
LMNA P02545 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 2/20 0.31
BRAF P15056 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
SCHEMBL26533212 1.00 THRB (0.32) THRBKRASPOLBLMNAMEN1
SCHEMBL26533081 0.92 LMNA (0.32) THRBKRASPOLBLMNAMEN1
SCHEMBL30776381 0.92 LMNA (0.32) THRBKRASPOLBLMNAMEN1
SCHEMBL30776322 0.91 EIF4EBP1 (0.35) KRAS
SCHEMBL26533082 0.91 LMNA (0.32) THRBKRASPOLBLMNAMEN1
SCHEMBL30776296 0.91 LMNA (0.32) THRBKRASPOLBLMNAMEN1
SCHEMBL27084033 0.91 KRAS (0.33) KRASPOLBLMNAHPGDALDH1A1
SCHEMBL30776371 0.89 LMNA (0.34) THRBKRASPOLBLMNAMEN1
SCHEMBL26532869 0.89 LMNA (0.34) THRBKRASPOLBLMNAMEN1
SCHEMBL30776429 0.88 MAPK8 (0.32) THRBKRASPOLBLMNAMEN1

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-20250289830-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2025-09-18 US disclosed
US-12351591-B2 KRas inhibitors ELI LILLY AND COMPANY (US) 2025-07-08 US disclosed
US-20240043451-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2024-02-08 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 (3 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-20240043451-A1 KRAS INHIBITORS KRAS, NRAS, HRAS THRB 1443/4885KRAS 1/4885POLB 1641/4885
US-12351591-B2 KRas inhibitors KRAS, NRAS, HRAS THRB 1443/4885KRAS 1/4885POLB 1641/4885
US-20250289830-A1 KRAS INHIBITORS KRAS, NRAS, HRAS THRB 1443/4885KRAS 1/4885POLB 1641/4885

“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.