SCHEMBL22220391

SCHEMBL22220391

CC(C)(C)OC(=O)N1CCN(c2ncnc3c(F)c(-c4cccc5ccc(F)c(Cl)c45)ncc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.48
▸ CNR2 P34972 1/20 0.48
▸ KRAS P01116 12/20 0.44
▸ KIT P10721 2/20 0.44
▸ CKS1B P61024 2/20 0.41
▸ SKP1 P63208 2/20 0.41
▸ SKP2 Q13309 2/20 0.41
▸ GRIA1 P42261 1/20 0.40
▸ CXCR2 P25025 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ HMOX2 P30519 1/20 0.39
▸ CRYZ Q08257 1/20 0.39
▸ VAT1 Q99536 1/20 0.39
▸ RTN4 Q9NQC3 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39

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
SCHEMBL22220654 0.91 CNR1 (0.51) CNR1CNR2KRASKITCKS1B
SCHEMBL29889808 0.89 KRAS (0.43) CNR1CNR2KRASCKS1BSKP1
SCHEMBL27094339 0.89 KRAS (0.43) CNR1CNR2KRASCKS1BSKP1
SCHEMBL27094419 0.89 KRAS (0.44) CNR1CNR2KRASCKS1BSKP1
SCHEMBL29889590 0.89 KRAS (0.44) CNR1CNR2KRASCKS1BSKP1
SCHEMBL22220629 0.89 KRAS (0.43) CNR1CNR2KRAS
SCHEMBL22220540 0.89 KRAS (0.43) CNR1CNR2KRAS
SCHEMBL22586931 0.89 CNR1 (0.46) CNR1CNR2KRASKITCKS1B
SCHEMBL22220621 0.88 KRAS (0.46) CNR2KRASEGFRHMOX2CRYZ
SCHEMBL27094374 0.88 KRAS (0.44) CNR1CNR2KRASCKS1BSKP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548888-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2023-01-10 — — US disclosed
US-11548888-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2023-01-10 — — US disclosed
US-20200331911-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2020-10-22 — — US disclosed
US-20200331911-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2020-10-22 — — US disclosed
WO-2020146613-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2020-07-16 — — WO 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-11548888-B2 KRas G12C inhibitors KRAS, NRAS, HRAS CNR1 2951/4885CNR2 3784/4885KRAS 1/4885
US-20200331911-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS CNR1 2951/4885CNR2 3784/4885KRAS 1/4885

“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.

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