SCHEMBL12813751

SCHEMBL12813751

COc1ccc(-n2c(/C=C/c3ccc(N(C)C)cc3)nc3ccccc3c2=O)cc1

nearest known ligand 0.79

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.79
KMT2A Q03164 9/20 0.79
POLB P06746 3/20 0.71
PSMD14 O00487 1/20 0.71
USP2 O75604 1/20 0.69
TLR9 Q9NR96 1/20 0.69
MAPT P10636 5/20 0.66
KDM4E B2RXH2 2/20 0.66
ALDH1A1 P00352 2/20 0.66
LMNA P02545 2/20 0.66
HPGD P15428 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
KLK7 P49862 1/20 0.64
TP53 P04637 2/20 0.63
GAA P10253 1/20 0.59

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
SCHEMBL12813753 1.00 MEN1 (0.79) MEN1KMT2APOLBPSMD14USP2
SCHEMBL1961879 0.90 MEN1 (0.87) MEN1KMT2APOLBPSMD14MAPT
SCHEMBL1961880 0.90 MEN1 (0.87) MEN1KMT2APOLBPSMD14MAPT
SCHEMBL17489620 0.81 MEN1 (0.80) MEN1KMT2APOLBPSMD14MAPT
SCHEMBL12813614 0.80 MAPT (1.00) MEN1KMT2APOLBUSP2TLR9
SCHEMBL12813610 0.80 MAPT (1.00) MEN1KMT2APOLBUSP2TLR9
SCHEMBL12316853 0.79 MEN1 (0.90) MEN1KMT2APOLBPSMD14MAPT
SCHEMBL1961886 0.78 MAPT (0.84) MEN1KMT2APOLBPSMD14MAPT
SCHEMBL1961884 0.78 MAPT (0.84) MEN1KMT2APOLBPSMD14MAPT
SCHEMBL1960111 0.78 MEN1 (0.80) MEN1KMT2APOLBUSP2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10316371-B2 Screening methods for identifying specific Staphylococcus aureus inhibitors TRANA DISCOVERY, INC. (US) 2019-06-11 US claimed
US-20140163037-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2014-06-12 US claimed
EP-2691542-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS Trana Discovery, Inc. (US) 2014-02-05 EP claimed
WO-2012135416-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2012-10-04 WO claimed
US-10316371-B2 Screening methods for identifying specific Staphylococcus aureus inhibitors TRANA DISCOVERY, INC. (US) 2019-06-11 US disclosed
US-10316371-B2 Screening methods for identifying specific Staphylococcus aureus inhibitors TRANA DISCOVERY, INC. (US) 2019-06-11 US disclosed
US-20140163037-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2014-06-12 US disclosed
US-20140163037-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2014-06-12 US disclosed
US-20140163037-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2014-06-12 US disclosed
EP-2691542-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS Trana Discovery, Inc. (US) 2014-02-05 EP disclosed
WO-2012135416-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2012-10-04 WO disclosed
WO-2012135416-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2012-10-04 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 (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-20140163037-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS NSUN3, RNGTT, TRMT1 MEN1 3734/4885KMT2A 1190/4885POLB 401/4885
US-10316371-B2 Screening methods for identifying specific Staphylococcus aureus inhibitors NSUN3, RNGTT, TRMT1 MEN1 3734/4885KMT2A 1190/4885POLB 401/4885

“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.