SCHEMBL4358099

SCHEMBL4358099

S=COC=Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.46
TRPA1 O75762 3/20 0.40
NFE2L2 Q16236 3/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
CYP19A1 P11511 1/20 0.39
MAOA P21397 1/20 0.39
ALOX5 P09917 1/20 0.39
MAPK1 P28482 1/20 0.39
IDO1 P14902 2/20 0.39
HDAC3 O15379 1/20 0.38
TNKS O95271 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38

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
SCHEMBL175340 0.85 MAOB (0.55) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL175339 0.85 MAOB (0.55) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL9491570 0.78 MAOB (0.48) MAOBTRPA1NFE2L2ALDH1A1LMNA
Formaldehyde SCHEMBL21494178 0.78 MAOB (0.48) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL20454571 0.76 ALDH1A1 (0.46) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL173274 0.76 ALDH1A1 (0.50) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL29142798 0.76 MAOB (0.46) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL18566704 0.76 MAOB (0.46) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL12298544 0.76 ALDH1A1 (0.50) MAOBTRPA1NFE2L2ALDH1A1LMNA
SCHEMBL374820 0.76 ALDH1A1 (0.46) MAOBTRPA1NFE2L2ALDH1A1LMNA

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
EP-1777239-B1 Half-metallocene catalyst and process for preparing syndiotactic styrene polymer using the same LG CHEMICAL LTD (KR) 2014-09-10 EP disclosed
US-7592401-B2 Multinuclear half metallocene catalyst and method for preparing syndiotatic polystyrene using the same LG CHEM, LTD. (KR) 2009-09-22 US disclosed
US-7592404-B2 Half metallocene catalyst and process for preparing syndiotactic styren polymer using the same LG CHEM, LTD. (KR) 2009-09-22 US disclosed
US-20070105710-A1 Half metallocene catalyst and process for preparing syndiotactic styren polymer using the same LG CHEM, LTD. (KR) 2007-05-10 US disclosed
US-20070100095-A1 Multinuclear half metallocene catalyst and method for preparing syndiotatic polystyren using the same LG CHEM, LTD. (KR) 2007-05-03 US disclosed
EP-1777230-A1 Multinuclear half metallocene catalyst and method for preparing syndiotactic polystyrene using the same LG Chem Ltd. (KR) 2007-04-25 EP disclosed
EP-1777239-A1 Half-metallocene catalyst and process for preparing syndiotactic styrene polymer using the same LG Chem Ltd. (KR) 2007-04-25 EP disclosed
EP-1404690-B1 NOVEL MULTINUCLEAR HALF METALLOCENE CATALYST AND PREPARATION OF STYRENE POLYMER USING THE SAME LG CHEMICAL LTD (KR) 2006-01-25 EP disclosed
US-6894129-B2 Multinuclear half metallocene catalyst and preparation of styrene polymer using the same LG CHEM, LTD. (KR) 2005-05-17 US disclosed
EP-1404690-A1 NOVEL MULTINUCLEAR HALF METALLOCENE CATALYST AND PREPARATION OF STYRENE POLYMER USING THE SAME LG Chem, Ltd. (KR) 2004-04-07 EP disclosed
US-20040048737-A1 Novel multinuclear half metallocene catalyst and preparation of styrene polymer using the same LG CHEM, LTD. (KR) 2004-03-11 US disclosed
WO-2003006473-A1 NOVEL MULTINUCLEAR HALF METALLOCENE CATALYST AND PREPARATION OF STYRENE POLYMER USING THE SAME LG CHEM, LTD. (KR) 2003-01-23 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-20040048737-A1 Novel multinuclear half metallocene catalyst and preparation of styrene polymer using the same SDC1, SDC4, TIMCC MAOB 4778/4885TRPA1 607/4885NFE2L2 2370/4885

“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.