SCHEMBL33526104

SCHEMBL33526104

N#Cc1c(N)sc2c(F)cnc(-c3c4c(c5c(N[C@@H]6CC[C@H]7CCCN7C6=O)ncnc5c3Cl)COC4)c12

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTK Q06187 17/20 0.35
KRAS P01116 1/20 0.33
CD69 Q07108 1/20 0.33
LRRK2 Q5S007 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31

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
SCHEMBL33526235 0.90 KRAS (0.42) BTKKRASCD69
SCHEMBL33526211 0.87 BTK (0.37) BTKKRASCD69PIK3CDPIK3CA
SCHEMBL33527124 0.86 KRAS (0.43) BTKKRASPIK3CD
SCHEMBL33525783 0.86 GPR119 (0.32) BTK
SCHEMBL33526669 0.83 PIK3CD (0.35) BTKLRRK2PIK3CDPIK3CAPIK3CB
SCHEMBL33525701 0.81 BTK (0.36) BTKKRASCD69LRRK2PIK3CD
SCHEMBL33525656 0.80 KRAS (0.38) BTKKRASCD69
SCHEMBL33525729 0.78 KRAS (0.36) BTKKRASCD69
SCHEMBL33526366 0.78 BTK (0.39) BTKCD69
SCHEMBL33525563 0.74 BTK (0.38) 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 350/4885KRAS 1/4885CD69 4692/4885
US-20260092075-A1 KRAS INHIBITORS KRAS, NRAS, HRAS BTK 389/4885KRAS 1/4885CD69 4745/4885

“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.