SCHEMBL25400372

SCHEMBL25400372

CC(=O)OC1O[C@](CCl)(COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 1/20 0.35
▸ CYP2D6 P10635 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ GSTP1 P09211 2/20 0.34
▸ METAP2 P50579 2/20 0.33
▸ NT5E P21589 1/20 0.33
▸ PRKCA P17252 1/20 0.33
▸ CAPN1 P07384 1/20 0.33
▸ BCHE P06276 1/20 0.33
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL25400002 1.00 ALDH1A1 (0.36) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL25400006 1.00 ALDH1A1 (0.36) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL23152976 0.90 ALDH1A1 (0.37) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL20756448 0.90 ALDH1A1 (0.37) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL30590044 0.89 ALDH1A1 (0.36) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL21418923 0.89 ALDH1A1 (0.36) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL6834854 0.89 ALDH1A1 (0.36) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL1098278 0.89 ALDH1A1 (0.42) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL30689531 0.89 ALDH1A1 (0.36) ALDH1A1LMNACYP2D6MAPK1GSTP1
SCHEMBL17958889 0.89 ALDH1A1 (0.36) ALDH1A1LMNACYP2D6MAPK1GSTP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230374058-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. 2023-11-23 — — US disclosed
US-20230374058-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. 2023-11-23 — — US disclosed
WO-2023178133-A9 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. (US) 2023-10-26 — — WO disclosed
WO-2023178133-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. (US) 2023-09-21 — — WO disclosed
US-20230295212-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS INC (US) 2023-09-21 — — US disclosed
US-20230295212-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS INC (US) 2023-09-21 — — 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 (2 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-20230295212-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE EHMT1, POLRMT, RNASE1 ALDH1A1 997/4885LMNA 2032/4885CYP2D6 3188/4885
US-20230374058-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE EHMT1, POLRMT, RNASE1 ALDH1A1 997/4885LMNA 2032/4885CYP2D6 3188/4885

“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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