SCHEMBL21543025

SCHEMBL21543025

CC(C)c1cccc(C(C)C)c1C(=O)c1nc(-c2ccccc2F)c(Cl)cc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KRAS P01116 5/20 0.39
CTSA P10619 7/20 0.39
ACMSD Q8TDX5 1/20 0.38
RORC P51449 1/20 0.37
TGFBR1 P36897 1/20 0.37
DHODH Q02127 1/20 0.36
EIF4E P06730 1/20 0.36
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL31745368 1.00 KRAS (0.39) KRASCTSAACMSDRORCTGFBR1
SCHEMBL31745322 0.92 KRAS (0.39) KRASCTSAACMSDRORC
SCHEMBL21543251 0.92 KRAS (0.39) KRASCTSAACMSDRORC
SCHEMBL21542735 0.89 CTSA (0.41) KRASCTSATGFBR1NPC1RAB9A
SCHEMBL21542579 0.81 NPC1 (0.45) ACMSDDHODHEIF4ENPC1RAB9A
SCHEMBL31745254 0.78 KRAS (0.42) KRASCTSATGFBR1DHODH
SCHEMBL21543516 0.78 KRAS (0.42) KRASCTSATGFBR1DHODH
SCHEMBL21567675 0.77 KRAS (0.33) KRAS
SCHEMBL21543189 0.75 KEAP1 (0.53) ACMSDDHODHEIF4ENPC1RAB9A
SCHEMBL31745387 0.75 KEAP1 (0.53) ACMSDDHODHEIF4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12440491-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2025-10-14 US disclosed
US-20240050430-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. 2024-02-15 US disclosed
EP-3788038-B1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC (US) 2023-10-11 EP disclosed
US-11766436-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2023-09-26 US disclosed
US-11766436-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2023-09-26 US disclosed
US-20220395504-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. 2022-12-15 US disclosed
US-11090304-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2021-08-17 US disclosed
EP-3788038-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME Amgen Inc. (US) 2021-03-10 EP disclosed
US-20190343838-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. 2019-11-14 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 (6 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-20190343838-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS KRAS 1/4885CTSA 3178/4885ACMSD 4805/4885
US-11090304-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS KRAS 1/4885CTSA 3178/4885ACMSD 4805/4885
US-12440491-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS KRAS 1/4885CTSA 3178/4885ACMSD 4805/4885
US-20220395504-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS KRAS 1/4885CTSA 3178/4885ACMSD 4805/4885
US-20240050430-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS KRAS 1/4885CTSA 3178/4885ACMSD 4805/4885
US-11766436-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS KRAS 1/4885CTSA 3178/4885ACMSD 4805/4885

“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.