SCHEMBL33525701

SCHEMBL33525701

N#Cc1c(N)sc2ccc(F)c(-c3c4c(c5c(N[C@@H]6CC[C@H]7CCCN7C6=O)ncnc5c3F)COC4)c12

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTK Q06187 17/20 0.36
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
KRAS P01116 1/20 0.32
CD69 Q07108 1/20 0.32
LRRK2 Q5S007 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
SCHEMBL33526211 0.93 BTK (0.37) BTKPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL33525755 0.89 KRAS (0.33) KRAS
SCHEMBL33526682 0.88 KRAS (0.31) KRAS
SCHEMBL33525627 0.85 GPR119 (0.33) BTK
SCHEMBL33526235 0.83 KRAS (0.42) BTKKRASCD69
SCHEMBL33526669 0.83 PIK3CD (0.35) BTKPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL33526104 0.81 BTK (0.35) BTKPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL33525638 0.81 BTK (0.30) BTK
SCHEMBL33527124 0.79 KRAS (0.43) BTKPIK3CDKRAS
SCHEMBL33526366 0.79 BTK (0.39) BTKCD69

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 350/4885PIK3CD 266/4885PIK3CA 73/4885
US-20260092075-A1 KRAS INHIBITORS KRAS, NRAS, HRAS BTK 389/4885PIK3CD 249/4885PIK3CA 61/4885

“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.