SCHEMBL1964863

SCHEMBL1964863

O=C(O)c1cc2nc(Nc3c(Cl)cccc3Cl)[nH]c2cc1F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 1/20 0.47
PTGES O14684 12/20 0.45
POLB P06746 1/20 0.43
DDX3X O00571 1/20 0.42
DHODH Q02127 1/20 0.41
AKR1C3 P42330 1/20 0.41
EGFR P00533 1/20 0.41
LCK P06239 1/20 0.41
SRC P12931 1/20 0.41
ZAP70 P43403 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL1966642 0.95 HDAC11 (0.47) HDAC11PTGESPOLBDDX3XDHODH
SCHEMBL13393191 0.89 HDAC11 (0.47) HDAC11PTGESEGFRLCKSRC
SCHEMBL1964691 0.89 POLB (0.45) HDAC11PTGESPOLBDDX3XAKR1C3
SCHEMBL1970430 0.88 PTGES (0.43) HDAC11PTGESPOLBDDX3XDHODH
SCHEMBL1969553 0.86 LCK (0.46) HDAC11PTGESPOLBDDX3XAKR1C3
SCHEMBL5695251 0.85 HDAC11 (0.52) HDAC11PTGESEGFRLCKSRC
Hydrochloric Acid SCHEMBL5695285 0.83 HDAC11 (0.51) HDAC11PTGESEGFRLCKSRC
SCHEMBL1973222 0.83 PTGES (0.56) HDAC11PTGES
SCHEMBL1968284 0.83 HDAC11 (0.52) HDAC11PTGESPOLBDDX3XEGFR
SCHEMBL13392979 0.81 PTGES (0.59) HDAC11PTGESKDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8916599-B2 1H-benz imidazole-5-carboxamides as anti-inflammatory agents OREXO AB (SE) 2014-12-23 US claimed
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 US claimed
EP-2334652-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-06-22 EP claimed
WO-2010034796-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO claimed
US-20150011513-A1 ALKYNE-, AZIDE- AND TRIAZOLE-CONTAINING FLAVONOIDS AS MODULATORS FOR MULTIDRUG RESISTANCE IN CANCERS THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2015-01-08 US disclosed
US-8916599-B2 1H-benz imidazole-5-carboxamides as anti-inflammatory agents OREXO AB (SE) 2014-12-23 US disclosed
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 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-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents MAPRE2, MAPRE1, H1-4 HDAC11 158/4885PTGES 118/4885POLB 3740/4885
US-20150011513-A1 ALKYNE-, AZIDE- AND TRIAZOLE-CONTAINING FLAVONOIDS AS MODULATORS FOR MULTIDRUG RESISTANCE IN CANCERS ABCG2, ABCB1, ABCC1 HDAC11 2169/4885PTGES 3823/4885POLB 2321/4885

“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.