SCHEMBL29411737

SCHEMBL29411737

COc1cc(C=O)cc(F)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.52
▸ TSHR P16473 2/20 0.52
▸ TUBB1 Q9H4B7 4/20 0.49
▸ HPGD P15428 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ TRIM24 O15164 1/20 0.47
▸ ALDH5A1 P51649 1/20 0.47
▸ ABAT P80404 1/20 0.47
▸ TRIM33 Q9UPN9 1/20 0.47
▸ ALOX5 P09917 2/20 0.45
▸ STAT3 P40763 2/20 0.45
▸ NFE2L2 Q16236 2/20 0.45
▸ PTGES O14684 1/20 0.45
▸ PTGS1 P23219 1/20 0.45
▸ FDPS P14324 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 1/20 0.44
▸ AOX1 Q06278 1/20 0.43
▸ GAA P10253 1/20 0.41

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
SCHEMBL5200065 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTUBB1HPGDTDP1
SCHEMBL11594562 0.90 ALDH1A1 (0.57) ALDH1A1TSHRTUBB1HPGDTDP1
SCHEMBL1766183 0.82 TUBB1 (0.50) ALDH1A1TSHRTUBB1HPGDTDP1
SCHEMBL6471117 0.82 ALDH1A1 (0.50) ALDH1A1TSHRTUBB1HPGDTDP1
SCHEMBL13512685 0.82 ALDH1A1 (0.50) ALDH1A1TSHRTUBB1HPGDTDP1
SCHEMBL29803132 0.82 TUBB1 (0.50) ALDH1A1TSHRTUBB1HPGDTDP1
SCHEMBL564282 0.81 ALOX5 (0.66) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL23904949 0.79 ERN1 (0.50) ALDH1A1TSHRTUBB1HPGDTDP1
SCHEMBL31172914 0.78 ALDH1A1 (0.50) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL31128571 0.78 ALDH1A1 (0.46) ALDH1A1TSHRHPGDTDP1TRIM24

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-12528828-B2 Substituted pyrido[4,3-d]pyrimidines as KRAS modulators ALTEROME THERAPEUTICS, INC. (US) 2026-01-20 — — US disclosed
US-20250346610-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS ALTEROME THERAPEUTICS INC (US) 2025-11-13 — — US disclosed
US-12466842-B2 Substituted pyrido [4,3-d]pyrimidines as KRAS modulators ALTEROME THERAPEUTICS, INC. (US) 2025-11-11 — — US disclosed
US-20250282799-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS ALTEROME THERAPEUTICS, INC. 2025-09-11 — — US disclosed
US-20250179093-A1 KRAS MODULATORS ALTEROME THERAPEUTICS, INC. 2025-06-05 — — US disclosed
WO-2025064542-A1 KRAS MODULATORS ALTEROME THERAPEUTICS, INC. (US) 2025-03-27 — — WO disclosed
EP-4200286-A1 COMPOUNDS AND METHODS OF MODULATING 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 Metrea Biosciences, Inc. (US) 2023-06-28 — — EP disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
WO-2022040324-A1 COMPOUNDS AND METHODS OF MODULATING 17β-ΗYDROXYSTEROID DEHYDROGENASE TYPE 13 METREA BIOSCIENCES, INC. (US) 2022-02-24 — — 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 (5 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-20250179093-A1 KRAS MODULATORS KRAS, NRAS, HRAS ALDH1A1 4071/4885TSHR 4177/4885TUBB1 3729/4885
US-20250346610-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS KRAS, NRAS, HRAS ALDH1A1 3593/4885TSHR 3993/4885TUBB1 3904/4885
US-12466842-B2 Substituted pyrido [4,3-d]pyrimidines as KRAS modulators KRAS, NRAS, HRAS ALDH1A1 3593/4885TSHR 3993/4885TUBB1 3904/4885
US-20250282799-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS KRAS, NRAS, HRAS ALDH1A1 3593/4885TSHR 3993/4885TUBB1 3904/4885
US-12528828-B2 Substituted pyrido[4,3-d]pyrimidines as KRAS modulators KRAS, NRAS, HRAS ALDH1A1 1854/4885TSHR 263/4885TUBB1 1749/4885

“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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