SCHEMBL21393070

SCHEMBL21393070

COc1ccc(C2CC(c3ccc(Br)cc3)=NN2C(=O)CCl)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ YAP1 P46937 3/20 0.69
▸ TEAD4 Q15561 3/20 0.69
▸ MAOA P21397 1/20 0.64
▸ MAOB P27338 1/20 0.64
▸ RNF114 Q9Y508 1/20 0.62
▸ CA1 P00915 1/20 0.58
▸ CA2 P00918 1/20 0.58
▸ ACHE P22303 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ KDM4E B2RXH2 4/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.53
▸ MAPT P10636 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ HTT P42858 1/20 0.52
▸ LMNA P02545 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ MEN1 O00255 2/20 0.51

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
SCHEMBL21392919 0.85 YAP1 (0.83) YAP1TEAD4MAOAMAOBRNF114
SCHEMBL25122626 0.85 RNF114 (0.83) YAP1TEAD4RNF114L3MBTL1POLB
SCHEMBL31574474 0.81 POLB (0.73) YAP1TEAD4MAOAMAOBCA1
SCHEMBL25546052 0.78 RNF114 (0.59) YAP1TEAD4RNF114CA1CA2
SCHEMBL25542768 0.76 YAP1 (0.85) YAP1TEAD4MAOAMAOBPOLB
SCHEMBL23518782 0.76 RNF114 (0.78) YAP1TEAD4RNF114ACHEL3MBTL1
SCHEMBL27465865 0.75 RNF114 (0.88) YAP1TEAD4MAOAMAOBRNF114
SCHEMBL30688878 0.74 RNF114 (0.88) YAP1TEAD4RNF114ACHEPOLB
SCHEMBL23518678 0.73 RNF114 (0.91) YAP1TEAD4MAOAMAOBRNF114
SCHEMBL25546065 0.73 YAP1 (0.69) YAP1TEAD4MAOAMAOBRNF114

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11666661-B2 Methods and compounds for targeted autophagy THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-06 — — US disclosed
US-11666661-B2 Methods and compounds for targeted autophagy THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-06 — — US disclosed
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-02 — — US disclosed
WO-2019183600-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-09-26 — — WO disclosed
US-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY FRONTIER MEDICINES CORPORATION 2019-09-26 — — 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 (3 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-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY ATG7, BECN1, SQSTM1 YAP1 1622/4885TEAD4 1748/4885MAOA 3322/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 YAP1 383/4885TEAD4 1187/4885MAOA 3431/4885
US-11666661-B2 Methods and compounds for targeted autophagy ATG7, BECN1, SQSTM1 YAP1 1622/4885TEAD4 1748/4885MAOA 3322/4885

“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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