SCHEMBL9486552

SCHEMBL9486552

CCOC(=O)COCc1ccc(O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.50
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CA7 P43166 4/20 0.50
CA9 Q16790 4/20 0.50
CA14 Q9ULX7 4/20 0.50
KMT2A Q03164 2/20 0.50
HRH3 Q9Y5N1 1/20 0.50
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
MEN1 O00255 1/20 0.46
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
MIF P14174 2/20 0.43
GAA P10253 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NLRP3 Q96P20 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL15874802 0.86 HRH3 (0.48) KMT2AHRH3MEN1CYP4F2CYP4A11
SCHEMBL52219 0.86 ALDH1A1 (0.52) KMT2AHRH3MEN1GAALMNA
SCHEMBL11084824 0.85 KMT2A (0.50) CA1CA2KMT2AHRH3MEN1
SCHEMBL5279749 0.81 LMNA (0.53) KDM4ELMNAMAPT
SCHEMBL13791088 0.80 NLRP3 (0.47) CA12CA1CA2CA7CA9
SCHEMBL20442640 0.80 NR1H4 (0.60) LMNA
SCHEMBL21068721 0.80 GAA (0.48) HRH3CYP4F2CYP4A11GAANPSR1
SCHEMBL1179218 0.79 CYP4Z1 (0.55) CA12CA1CA2CA7CA9
SCHEMBL10545852 0.79 ESR2 (0.56) CA12CA1CA2CA7CA9
SCHEMBL21801168 0.78 ALDH1A1 (0.47) KMT2AMEN1LMNA

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-20220267305-A1 MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2022-08-25 US disclosed
US-11384063-B2 Modulators of estrogen receptor proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2022-07-12 US disclosed
US-20200199107-A1 MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE Arvinas, Inc. 2020-06-25 US disclosed
US-10604506-B2 Modulators of estrogen receptor proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2020-03-31 US disclosed
WO-2018140809-A1 MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE Arvinas, Inc. (US) 2018-08-02 WO disclosed
US-5274162-A Antineoplastic drugs with bipolar toxification/detoxification functionalities GLAZIER ARNOLD (US) 1993-12-28 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 (4 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-10604506-B2 Modulators of estrogen receptor proteolysis and associated methods of use ADRM1, MDM2, ESR2 CA12 3428/4885CA1 1500/4885CA2 3519/4885
US-11384063-B2 Modulators of estrogen receptor proteolysis and associated methods of use ADRM1, MDM2, ESR2 CA12 3428/4885CA1 1500/4885CA2 3519/4885
US-20200199107-A1 MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE ADRM1, MDM2, ESR2 CA12 3428/4885CA1 1500/4885CA2 3519/4885
US-20220267305-A1 MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE ADRM1, MDM2, ESR2 CA12 3428/4885CA1 1500/4885CA2 3519/4885

“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.