SCHEMBL33525743

SCHEMBL33525743

C[C@H]1[C@@H](N(C)C)CCN1c1cc(N[C@@H]2CC[C@H]3CCCN3C2=O)c2c3c(c(-c4ccc(F)c5sc(N)nc45)c(F)c2n1)COC3

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.34

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
SCHEMBL33526185 0.91 BTK (0.31) BTK
SCHEMBL33526085 0.89 BTK (0.32) BTK
SCHEMBL33525821 0.88 BTK (0.30) BTK
SCHEMBL33525965 0.86 BTK (0.31) BTK
SCHEMBL33525564 0.85 BTK (0.30) BTK
SCHEMBL33526003 0.83
SCHEMBL33526164 0.83 BTK (0.31) BTK
SCHEMBL33525590 0.82 BTK (0.34) BTK
SCHEMBL33525994 0.81 BTK (0.32) BTK
SCHEMBL33526069 0.80

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12600733-B2 KRAS inhibitors ELI LILLY AND COMPANY (US) 2026-04-14 US disclosed
US-20260092075-A1 KRAS INHIBITORS LILLY CO ELI (US) 2026-04-02 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-12600733-B2 KRAS inhibitors KRAS, NRAS, HRAS BTK 350/4885
US-20260092075-A1 KRAS INHIBITORS KRAS, NRAS, HRAS BTK 389/4885

“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.