SCHEMBL31562461

SCHEMBL31562461

COC(=O)[C@@H](C)Oc1cc(OC)cc(O)c1C=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 1/20 0.63
▸ LMNA P02545 1/20 0.43
▸ CYP3A4 P08684 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ABCG2 Q9UNQ0 4/20 0.40
▸ CHRNA7 P36544 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ ESR1 P03372 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ TRIM24 O15164 1/20 0.39
▸ TYR P14679 1/20 0.39
▸ TRIM33 Q9UPN9 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ DPP4 P27487 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39

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
SCHEMBL31562691 0.87 ERN1 (0.65) ERN1LMNACYP3A4SMN1; SMN2USP2
SCHEMBL31562831 0.80 HDAC8 (0.47) ERN1LMNACYP3A4SMN1; SMN2KDM4E
SCHEMBL31562452 0.80 HDAC8 (0.47) ERN1LMNACYP3A4SMN1; SMN2KDM4E
SCHEMBL829755 0.78 ERN1 (1.00) ERN1LMNACYP3A4SMN1; SMN2USP2
SCHEMBL30294862 0.77 ERN1 (0.96) ERN1LMNACYP3A4SMN1; SMN2USP2
SCHEMBL7031594 0.75 ERN1 (0.78) ERN1LMNACYP3A4SMN1; SMN2USP2
SCHEMBL23442397 0.72 ERN1 (0.73) ERN1LMNACYP3A4SMN1; SMN2USP2
SCHEMBL31562188 0.71 ERN1 (0.67) ERN1LMNACYP3A4SMN1; SMN2USP2
SCHEMBL5623138 0.71 ERN1 (0.71) ERN1LMNACYP3A4SMN1; SMN2USP2
SCHEMBL4833961 0.70 ERN1 (0.60) ERN1LMNACYP3A4MAPK1CHRNA7

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 ERN1 1389/4885LMNA 1059/4885CYP3A4 2478/4885

“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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