SCHEMBL31562597

SCHEMBL31562597

COc1ccc(COc2cc(C)cc(OCC(=O)O)c2C=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 8/20 0.52
▸ FFAR1 O14842 5/20 0.52
▸ PPARG P37231 4/20 0.52
▸ PPARA Q07869 4/20 0.52
▸ KEAP1 Q14145 2/20 0.47
▸ NFE2L2 Q16236 2/20 0.47
▸ HDAC8 Q9BY41 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PLA2G4B P0C869 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL31562333 0.89 GAA (0.49) PPARDPPARGPPARAKEAP1NFE2L2
SCHEMBL22090729 0.87 SMN1; SMN2 (0.53) HDAC8NPC1RAB9ASMN1; SMN2POLB
SCHEMBL28491464 0.85 HDAC8 (0.53) PPARDFFAR1PPARGPPARAHDAC8
SCHEMBL29846122 0.85 HDAC8 (0.53) PPARDFFAR1PPARGPPARAHDAC8
SCHEMBL31562639 0.84 ERN1 (0.52) FFAR1KEAP1NFE2L2HDAC8NPC1
SCHEMBL5556434 0.77 LMNA (0.57) PPARDPPARGPPARAHDAC8SMN1; SMN2
SCHEMBL31562314 0.77 L3MBTL1 (0.51) PPARDFFAR1PPARGPPARAHDAC8
SCHEMBL22090739 0.76 SMN1; SMN2 (0.52) HDAC8NPC1RAB9ASMN1; SMN2POLB
SCHEMBL31562872 0.75 ABCB1 (0.49) HDAC8NPC1RAB9ASMN1; SMN2POLB
SCHEMBL28491465 0.75 ABCB1 (0.49) HDAC8NPC1RAB9ASMN1; SMN2POLB

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-20250289789-A1 REVERSIBLE LYSINE COVALENT MODIFIERS OF CDK2 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. 2025-09-18 — — US disclosed
WO-2025090658-A2 REVERSIBLE LYSINE COVALENT MODIFIERS OF CDK2 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2025-05-01 — — 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-20250289789-A1 REVERSIBLE LYSINE COVALENT MODIFIERS OF CDK2 AND USES THEREOF CDK2, CDK20, CDK1 PPARD 2271/4885FFAR1 4852/4885PPARG 1618/4885

“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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