SCHEMBL21458573

SCHEMBL21458573

COCOc1cc(-c2c(Cl)cc3c(N4CCN(C(=O)O)C(C(C)(C)C)C4)ncnc3c2F)c2ccccc2c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KRAS P01116 16/20 0.45
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
LIMK2 P53671 1/20 0.35
SOS1 Q07889 1/20 0.34
PDGFRB P09619 2/20 0.34
PDGFRA P16234 1/20 0.34
TNF P01375 1/20 0.33
NOD1 Q9Y239 1/20 0.33

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
SCHEMBL21458484 0.84 KRAS (0.51) KRASEGFRHMOX2CRYZVAT1
SCHEMBL22973190 0.80 KRAS (0.49) KRASEGFRHMOX2CRYZVAT1
SCHEMBL16637039 0.79 KRAS (0.50) KRASEGFRHMOX2CRYZVAT1
SCHEMBL29937417 0.76 KRAS (0.41) KRAS
SCHEMBL27003401 0.76 KRAS (0.41) KRAS
SCHEMBL16636605 0.76 KRAS (0.47) KRAS
SCHEMBL16637034 0.74 KIT (0.37) KRASEGFRHMOX2CRYZVAT1
SCHEMBL27209833 0.74 KRAS (0.44) KRAS
SCHEMBL29939614 0.73 KRAS (0.39) KRAS
SCHEMBL29678727 0.73 KRAS (0.39) KRAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552783-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2026-02-17 US disclosed
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2022-12-22 US disclosed
US-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2019-10-17 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 (4 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-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL KRAS 242/4885EGFR 2207/4885HMOX2 764/4885
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL KRAS 242/4885EGFR 2207/4885HMOX2 764/4885
US-12552783-B2 Modulators of proteolysis and associated methods of use CRBN, ADRM1, MDM2 KRAS 289/4885EGFR 1180/4885HMOX2 2100/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL KRAS 242/4885EGFR 2207/4885HMOX2 764/4885

“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.