SCHEMBL7041384

SCHEMBL7041384

ON1CN=Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 10/20 0.35
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
SCN4A P35499 1/20 0.34
SCN5A Q14524 1/20 0.34
SCN9A Q15858 1/20 0.34
P2RX1 P51575 4/20 0.33
P2RX3 P56373 4/20 0.33
P2RX7 Q99572 2/20 0.33
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31

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
SCHEMBL2263869 0.75 KDM4E (0.32) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL3541130 0.75 LMNA (0.34) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL31006068 0.75 KDM4E (0.32) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL5792018 0.75 LMNA (0.32) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL28222693 0.73 LMNA (0.39) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL7029078 0.73 P2RX4 (0.40) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL30081007 0.73 P2RX4 (0.40) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL28784154 0.72 P2RX4 (0.53) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL30843927 0.72 SIGMAR1 (0.36) P2RX4LMNA
SCHEMBL28234956 0.72 P2RX4 (0.34) P2RX4P2RX1P2RX3P2RX7MTNR1A

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-20030004157-A1 Use of NK-1 receptor antagonists against benign prostatic hyperplasia F. HOFFMANN-LA ROCHE AG (CH) 2003-01-02 US disclosed
US-5384405-A Zinc reduction of nitrobenzoate to hydroxylamine then reduction with isothiocyanate OLIN CORPORATION (US) 1995-01-24 US disclosed
EP-0606304-A4 N-HYDROXYQUINAZOLINONE AND 2-N-HYDROXYTHIOUREA BENZOATE COMPOUNDS AS BIOCIDES. OLIN CORP (US) 1994-11-09 EP disclosed
EP-0606304-A1 N-HYDROXYQUINAZOLINONE AND 2-N-HYDROXYTHIOUREA BENZOATE COMPOUNDS AS BIOCIDES OLIN CORPORATION (US) 1994-07-20 EP disclosed
US-5298249-A Uv stable fungicides OLIN CORPORATION (US) 1994-03-29 US disclosed
WO-1993006830-A1 N-HYDROXYQUINAZOLINONE AND 2-N-HYDROXYTHIOUREA BENZOATE COMPOUNDS AS BIOCIDES OLIN CORPORATION (US) 1993-04-15 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 (1 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-20030004157-A1 Use of NK-1 receptor antagonists against benign prostatic hyperplasia KLK3, TACR1, TACR2 P2RX4 129/4885LMNA 3289/4885TSHR 313/4885

“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.