SCHEMBL29901341

SCHEMBL29901341

CC(C)(C)OC(=O)NC1CCN(c2ncnc3c(F)c(-c4ccccc4F)c(Cl)cc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.54
CNR2 P34972 8/20 0.54
KRAS P01116 5/20 0.46
EGFR P00533 1/20 0.46
HMOX2 P30519 1/20 0.46
CRYZ Q08257 1/20 0.46
VAT1 Q99536 1/20 0.46
RTN4 Q9NQC3 1/20 0.46
CKS1B P61024 1/20 0.43
SKP1 P63208 1/20 0.43
SKP2 Q13309 1/20 0.43
BTK Q06187 1/20 0.41
DRD2 P14416 1/20 0.40

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
SCHEMBL23415335 1.00 CNR1 (0.54) CNR1CNR2KRASEGFRHMOX2
SCHEMBL23415339 0.87 KRAS (0.51) CNR1CNR2KRASEGFRHMOX2
SCHEMBL29901337 0.84 KRAS (0.56) CNR1CNR2KRASEGFRHMOX2
SCHEMBL29888689 0.84 KRAS (0.56) CNR1CNR2KRASEGFRHMOX2
SCHEMBL23415350 0.84 KRAS (0.56) CNR1CNR2KRASEGFRHMOX2
SCHEMBL23415323 0.82 CNR1 (0.48) CNR1CNR2KRASEGFRHMOX2
SCHEMBL29888416 0.82 CNR1 (0.48) CNR1CNR2KRASEGFRHMOX2
SCHEMBL23415476 0.81 KRAS (0.51) CNR1CNR2KRASEGFRHMOX2
SCHEMBL29901300 0.81 KRAS (0.51) CNR1CNR2KRASEGFRHMOX2
SCHEMBL28833844 0.80 KRAS (0.54) CNR1CNR2KRASEGFRHMOX2

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-20230100838-A1 COVALENT RAS INHIBITORS AND USES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-03-30 US disclosed
EP-4065231-A1 COVALENT RAS INHIBITORS AND USES THEREOF Revolution Medicines, Inc. (US) 2022-10-05 EP 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-20230100838-A1 COVALENT RAS INHIBITORS AND USES THEREOF KRAS, NRAS, HRAS CNR1 3958/4885CNR2 4218/4885KRAS 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.