SCHEMBL730692

SCHEMBL730692

O=C(O)/C=C/C=C/Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HCAR2 Q8TDS4 3/20 0.42
HDAC3 O15379 1/20 0.42
TNKS O95271 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
ALDH1A1 P00352 5/20 0.41
ALOX15 P16050 1/20 0.41
MASP2 O00187 1/20 0.41

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
SCHEMBL730693 1.00 HTT (0.47) HTTKDM4ESMN1; SMN2HCAR2HDAC3
SCHEMBL3045538 0.85 HTT (0.47) HTTKDM4ESMN1; SMN2HCAR2HDAC3
SCHEMBL226234 0.85 HTT (0.47) HTTKDM4ESMN1; SMN2HCAR2HDAC3
SCHEMBL12148887 0.83 GLA (0.44) HTTKDM4EALDH1A1ALOX15LMNA
SCHEMBL11541783 0.82 LTA4H (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11541789 0.82 LTA4H (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL12148886 0.82 ALOX15 (0.36) HTTKDM4ESMN1; SMN2HDAC3HDAC1
SCHEMBL12148884 0.80 RNF4 (0.37) HTTKDM4ESMN1; SMN2ALDH1A1ALOX15
SCHEMBL29049622 0.80 LTA4H (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8348919 0.79 MTNR1A (0.36) HTTKDM4ESMN1; SMN2HCAR2ALOX15

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138225-B2 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds ERRANT GENE THERAPEUTICS, LLC (US) 2012-03-20 US disclosed
US-8138225-B2 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds ERRANT GENE THERAPEUTICS, LLC (US) 2012-03-20 US disclosed
US-8138225-B2 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds ERRANT GENE THERAPEUTICS, LLC (US) 2012-03-20 US disclosed
US-20110288168-A1 HISTONE DEACETYLASE INHIBITORS ERRANT GENE THERAPEUTICS, LLC 2011-11-24 US disclosed
US-20110288168-A1 HISTONE DEACETYLASE INHIBITORS ERRANT GENE THERAPEUTICS, LLC 2011-11-24 US disclosed
US-20110288168-A1 HISTONE DEACETYLASE INHIBITORS ERRANT GENE THERAPEUTICS, LLC 2011-11-24 US disclosed
US-7842727-B2 Histone deacetylase inhibitors ERRANT GENE THERAPEUTICS, LLC (US) 2010-11-30 US disclosed
US-7842727-B2 Histone deacetylase inhibitors ERRANT GENE THERAPEUTICS, LLC (US) 2010-11-30 US disclosed
US-7842727-B2 Histone deacetylase inhibitors ERRANT GENE THERAPEUTICS, LLC (US) 2010-11-30 US disclosed
US-20100143961-A1 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds ERRANT GENE THERAPEUTICS, LLC 2010-06-10 US disclosed
US-20050282890-A1 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds LAN-HARGEST HSUAN-YIN 2005-12-22 US disclosed
EP-1511715-A1 HISTONE DEACETYLASE INHIBITORS BASED ON TRIHALOMETHYLCARBONYL COMPOUNDS Errant Gene Therapeutics, LLC (US) 2005-03-09 EP disclosed
EP-1511477-A1 HISTONE DEACETYLASE INHIBITORS BASED ON ALPHA-KETOEPOXIDE COMPOUNDS Errant Gene Therapeutics, LLC (US) 2005-03-09 EP disclosed
EP-1511729-A1 HISTONE DEACETYLASE INHIBITORS BASED ON ALPHACHALCOGENMETHYLCARBONYL COMPOUNDS Errant Gene Therapeutics, LLC (US) 2005-03-09 EP disclosed
US-20040029903-A1 Histone deacetylase inhibitors based on trihalomethylcarbonyl compounds BEACON LABORATORIES, INC. 2004-02-12 US disclosed
US-20040029922-A1 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds BEACON LABORATORIES, INC. 2004-02-12 US disclosed
US-20040023944-A1 Histone deacetylase inhibitors based on alpha-chalcogenmethylcarbonyl compounds BEACON LABORATORIES, INC. 2004-02-05 US disclosed
WO-2003099789-A1 HISTONE DEACETYLASE INHIBITORS BASED ON ALPHACHALCOGENMETHYLCARBONYL COMPOUNDS ERRANT GENE THERAPEUTICS, LLC. (US) 2003-12-04 WO disclosed
WO-2003099272-A1 HISTONE DEACETYLASE INHIBITORS BASED ON ALPHA-KETOEPOXIDE COMPOUNDS ERRANT GENE THERAPEUTICS, LLC (US) 2003-12-04 WO disclosed
WO-2003099760-A1 HISTONE DEACETYLASE INHIBITORS BASED ON TRIHALOMETHYLCARBONYL COMPOUNDS ERRANT GENE THERAPEUTICS, LLC. (US) 2003-12-04 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 (5 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-20040029922-A1 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds HDAC1, KAT2A, HDAC10 HTT 80/4885KDM4E 412/4885SMN1; SMN2 132/4885
US-20040023944-A1 Histone deacetylase inhibitors based on alpha-chalcogenmethylcarbonyl compounds HDAC1, HDAC10, KAT2A HTT 72/4885KDM4E 631/4885SMN1; SMN2 119/4885
US-20040029903-A1 Histone deacetylase inhibitors based on trihalomethylcarbonyl compounds HDAC1, HDAC3, HDAC9 HTT 48/4885KDM4E 1034/4885SMN1; SMN2 89/4885
US-20050282890-A1 Histone deacetylase inhibitors based on alpha-ketoepoxide compounds HDAC1, KAT2A, HDAC10 HTT 80/4885KDM4E 412/4885SMN1; SMN2 132/4885
US-20110288168-A1 HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC6, HDAC5 HTT 86/4885KDM4E 1872/4885SMN1; SMN2 100/4885

“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.