SCHEMBL20963587

SCHEMBL20963587

COC(=O)c1cc(OC(C)C)cc(/C(N)=N/O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ PARP10 Q53GL7 1/20 0.41
▸ USP2 O75604 1/20 0.40
▸ ULK1 O75385 1/20 0.40
▸ GLA P06280 1/20 0.39
▸ PRSS1 P07477 2/20 0.39
▸ F2 P00734 1/20 0.39
▸ PLG P00747 1/20 0.39
▸ PLAU P00749 1/20 0.39
▸ PLAT P00750 1/20 0.39
▸ KLKB1 P03952 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.38
▸ PTPN11 Q06124 1/20 0.38

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
SCHEMBL30745102 0.87 POLB (0.41) POLBKDM4EUSP2CA12CA1
SCHEMBL20963803 0.87 POLB (0.41) POLBKDM4EUSP2CA12CA1
SCHEMBL29278604 0.87 POLB (0.41) POLBKDM4EUSP2CA12CA1
SCHEMBL1791405 0.86 CA1 (0.50) POLBKDM4EPARP10USP2ULK1
SCHEMBL20944029 0.85 KMT2A (0.49) KDM4EPARP10GLAPRSS1F2
SCHEMBL20944031 0.85 KMT2A (0.49) KDM4EPARP10GLAPRSS1F2
SCHEMBL30614536 0.84 KDM4E (0.48) POLBKDM4EUSP2F2CA12
SCHEMBL29278609 0.84 KDM4E (0.48) POLBKDM4EUSP2F2CA12
SCHEMBL20963871 0.84 KDM4E (0.48) POLBKDM4EUSP2F2CA12
SCHEMBL1107694 0.82 CA1 (0.50) POLBKDM4EPARP10USP2ULK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111295382-B Bridged bicyclic compounds as farnesyl ester X receptor modulators 百时美施贵宝公司 2024-02-02 — — CN disclosed
EP-3704113-B1 BRIDGED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2023-10-11 — — EP disclosed
US-10730863-B2 Bridged bicyclic compounds as farnesoid X receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-08-04 — — US disclosed
US-20190127358-A1 BRIDGED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2019-05-02 — — 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-20190127358-A1 BRIDGED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS NR1H4, FXR1, NR1H2 POLB 4627/4885KDM4E 3658/4885PARP10 3759/4885
US-10730863-B2 Bridged bicyclic compounds as farnesoid X receptor modulators NR1H4, FXR1, NR1H2 POLB 4627/4885KDM4E 3658/4885PARP10 3759/4885

“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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