SCHEMBL27225472

SCHEMBL27225472

O=c1c(Oc2ccccc2)c(C(F)(F)F)oc2cc(O)ccc12

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.79
▸ ESR1 P03372 5/20 0.77
▸ ESR2 Q92731 5/20 0.77
▸ TTR P02766 1/20 0.71
▸ ALDH1A1 P00352 6/20 0.67
▸ KDM4E B2RXH2 5/20 0.67
▸ HPGD P15428 4/20 0.67
▸ GAA P10253 3/20 0.67
▸ GLA P06280 3/20 0.67
▸ HSD17B10 Q99714 3/20 0.67
▸ TSHR P16473 1/20 0.67
▸ HTT P42858 2/20 0.60
▸ NPC1 O15118 1/20 0.60
▸ RAB9A P51151 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ PSD A5PKW4 1/20 0.55
▸ KMT2A Q03164 4/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ POLB P06746 1/20 0.54
▸ MAPT P10636 4/20 0.54

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
SCHEMBL14156914 0.88 LMNA (1.00) LMNAESR1ESR2TTRALDH1A1
SCHEMBL13856884 0.88 LMNA (0.76) LMNAESR1ESR2TTRALDH1A1
SCHEMBL12325802 0.88 ESR1 (0.78) LMNAESR1ESR2TTRALDH1A1
SCHEMBL3723950 0.88 LMNA (0.76) LMNAESR1ESR2TTRALDH1A1
SCHEMBL14157022 0.85 LMNA (0.71) LMNAESR1ESR2TTRALDH1A1
SCHEMBL14157030 0.85 LMNA (0.73) LMNAESR1ESR2TTRALDH1A1
SCHEMBL14158220 0.84 LMNA (0.77) LMNAESR1ESR2TTRALDH1A1
SCHEMBL12156080 0.83 TTR (1.00) LMNAESR1ESR2TTRALDH1A1
SCHEMBL18550795 0.81 ALDH1A1 (1.00) LMNAESR1ESR2ALDH1A1KDM4E
SCHEMBL14156942 0.80 LMNA (0.64) LMNAESR1ESR2TTRALDH1A1

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-20240174649-A1 CULLIN-RING E3 UBIQUITIN LIGASE 4 INHIBITOR COMPOUNDS AND METHODS OF THEIR USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2024-05-30 — — US disclosed
WO-2022165432-A1 CULLIN-RING E3 UBIQUITIN LIGASE 4 INHIBITOR COMPOUNDS AND METHODS OF THEIR USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2022-08-04 — — 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-20240174649-A1 CULLIN-RING E3 UBIQUITIN LIGASE 4 INHIBITOR COMPOUNDS AND METHODS OF THEIR USE CUL4A, CUL1, CUL3 LMNA 2544/4885ESR1 1881/4885ESR2 879/4885

“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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