SCHEMBL28961002

SCHEMBL28961002

C#Cc1c(F)ccc2cc(O)cc(-c3ncc4c(N5CC6CC(C5)N6)nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)c12

nearest known ligand 0.94

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KRAS P01116 20/20 0.94
MAPK3 P27361 1/20 0.94
MAPK1 P28482 1/20 0.94
RAF1 P04049 1/20 0.77

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
Mrtx-1133 SCHEMBL26198316 0.97 KRAS (1.00) KRASMAPK3MAPK1RAF1
Mrtx-1133 SCHEMBL30437753 0.97 KRAS (1.00) KRASMAPK3MAPK1RAF1
Mrtx-1133 SCHEMBL29755891 0.97 KRAS (1.00) KRASMAPK3MAPK1RAF1
Mrtx-1133 SCHEMBL25381671 0.97 KRAS (1.00) KRASMAPK3MAPK1RAF1
Mrtx-1133 SCHEMBL25641063 0.97 KRAS (1.00) KRASMAPK3MAPK1RAF1
Mrtx-1133 SCHEMBL23053403 0.97 KRAS (1.00) KRASMAPK3MAPK1RAF1
Mrtx-1133 SCHEMBL30311229 0.97 KRAS (1.00) KRASMAPK3MAPK1RAF1
SCHEMBL28906479 0.96 KRAS (0.96) KRASMAPK3MAPK1RAF1
SCHEMBL25379515 0.95 KRAS (0.96) KRASMAPK3MAPK1RAF1
SCHEMBL26198170 0.95 KRAS (0.96) KRASMAPK3MAPK1RAF1

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-20240300980-A1 HETEROCYCLIC COMPOUNDS AS KRAS INHIBITOR, AND PREPARATION THEREFOR AND USE THEREOF IN TREATMENT SHANGHAI KECHOW PHARMA, INC. (CN) 2024-09-12 US disclosed
CN-115304623-A Pyrimido-cyclic derivative and application thereof in medicine 四川海思科制药有限公司 2022-11-08 CN 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 (1 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-20240300980-A1 HETEROCYCLIC COMPOUNDS AS KRAS INHIBITOR, AND PREPARATION THEREFOR AND USE THEREOF IN TREATMENT KRAS, NRAS, HRAS KRAS 1/4885MAPK3 188/4885MAPK1 53/4885

“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.