SCHEMBL22100172

SCHEMBL22100172

COc1ccc(CNC(=O)c2cc(Cl)ccc2O)cc1O

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DNMT3A Q9Y6K1 1/20 0.57
LMNA P02545 2/20 0.56
TRPV1 Q8NER1 3/20 0.56
P2RX1 P51575 1/20 0.56
TMPRSS4 Q9NRS4 1/20 0.56
TUBB P07437 2/20 0.54
KCNMA1 Q12791 1/20 0.53
HPGD P15428 1/20 0.53
NLRP3 Q96P20 1/20 0.52

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
SCHEMBL23657593 0.83 LMNA (0.72) DNMT3ALMNAHPGDNLRP3
SCHEMBL23675446 0.82 TUBB (0.72) LMNAP2RX1TMPRSS4TUBBKCNMA1
SCHEMBL13812914 0.82 P2RX1 (0.66) LMNAP2RX1TMPRSS4TUBB
SCHEMBL13753989 0.82 LMNA (0.62) DNMT3ALMNATRPV1KCNMA1HPGD
SCHEMBL28871890 0.81 HDAC3 (0.67) DNMT3ALMNATUBBHPGD
SCHEMBL30080912 0.81 HDAC3 (0.67) DNMT3ALMNATUBBHPGD
SCHEMBL11516368 0.81 LMNA (0.68) DNMT3ALMNAKCNMA1HPGDNLRP3
SCHEMBL26097052 0.80 HPGD (0.63) LMNAP2RX1TMPRSS4TUBBHPGD
SCHEMBL5065588 0.80 TRPV1 (0.59) LMNATRPV1HPGD
SCHEMBL26098397 0.79 P2RX1 (0.64) LMNAP2RX1TMPRSS4TUBBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11208371-B2 Compounds, compositions, and methods for use in treating autophagy-associated disorders BIOPHAGY INC (US) 2021-12-28 US disclosed
WO-2020131924-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS Biophagy, Inc. (US) 2020-06-25 WO disclosed
US-20200190007-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS BIOPHAGY INC (US) 2020-06-18 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-20200190007-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS BECN1, ATG7, SQSTM1 DNMT3A 3973/4885LMNA 372/4885TRPV1 1863/4885
US-11208371-B2 Compounds, compositions, and methods for use in treating autophagy-associated disorders BECN1, ATG7, SQSTM1 DNMT3A 3973/4885LMNA 372/4885TRPV1 1863/4885

“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.