SCHEMBL24459896

SCHEMBL24459896

COc1cccc(F)c1-c1c(Cl)cc2c(O)ccnc2c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 4/20 0.40
▸ EGFR P00533 1/20 0.40
▸ HMOX2 P30519 1/20 0.40
▸ CRYZ Q08257 1/20 0.40
▸ VAT1 Q99536 1/20 0.40
▸ RTN4 Q9NQC3 1/20 0.40
▸ MAPK14 Q16539 2/20 0.40
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ HTR5A P47898 1/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ WEE1 P30291 1/20 0.35
▸ CTSA P10619 2/20 0.35
▸ HSP90AA1 P07900 3/20 0.35
▸ HSP90AB1 P08238 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAP4K1 Q92918 1/20 0.35
▸ SCN9A Q15858 1/20 0.35
▸ HTR1A P08908 1/20 0.34
▸ ADRA1D P25100 1/20 0.34

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
SCHEMBL30534031 1.00 KRAS (0.40) KRASEGFRHMOX2CRYZVAT1
SCHEMBL29697501 0.86 MAPK14 (0.40) KRASEGFRHMOX2CRYZVAT1
SCHEMBL24459895 0.86 MAPK14 (0.40) KRASEGFRHMOX2CRYZVAT1
SCHEMBL18128619 0.84 KRAS (0.44) KRASEGFRHMOX2CRYZVAT1
SCHEMBL18128427 0.81 EGFR (0.41) KRASEGFRHMOX2CRYZVAT1
SCHEMBL18128526 0.79 NQO2 (0.36) KRASEGFRHMOX2CRYZVAT1
SCHEMBL18395037 0.77 PARP1 (0.47) KRASEGFRHMOX2CRYZVAT1
SCHEMBL20373555 0.76 F2RL3 (0.39) KRASEGFRHMOX2CRYZVAT1
SCHEMBL18128418 0.76 NQO2 (0.37) HSP90AA1HSP90AB1KDM4EMAP4K1
SCHEMBL30253478 0.76 NQO2 (0.37) HSP90AA1HSP90AB1KDM4EMAP4K1

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
WO-2024175998-A1 BENZENESULFONAMIDE DERIVATIVES AND USES THEREOF DUNAD THERAPEUTICS, LTD. (GB) 2024-08-29 — — WO disclosed
US-20240092756-A1 METHODS AND COMPOSITION FOR KRAS MODIFICATIONS DUNAD THERAPEUTICS LTD. (GB) 2024-03-21 — — US disclosed
EP-4247787-A2 METHODS AND COMPOSITION FOR KRAS MODIFICATIONS 2692372 Ontario, Inc. (CA) 2023-09-27 — — EP disclosed
WO-2022106897-A2 METHODS AND COMPOSITION FOR KRAS MODIFICATIONS 2692372 ONTARIO, INC. (CA) 2022-05-27 — — WO disclosed
WO-2022106897-A2 METHODS AND COMPOSITION FOR KRAS MODIFICATIONS 2692372 ONTARIO, INC. (CA) 2022-05-27 — — 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 (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-20240092756-A1 METHODS AND COMPOSITION FOR KRAS MODIFICATIONS KRAS, NRAS, HRAS KRAS 1/4885EGFR 64/4885HMOX2 3177/4885

“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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