SCHEMBL1973509

SCHEMBL1973509

Cc1c(Cl)cccc1NC(=O)c1ccc2[nH]c(Nc3c(Cl)cccc3Cl)nc2c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
NPSR1 Q6W5P4 1/20 0.47
PTGES O14684 1/20 0.47
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
EGFR P00533 1/20 0.44
LCK P06239 1/20 0.44
SRC P12931 1/20 0.44
ZAP70 P43403 1/20 0.44
TP53 P04637 1/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
OPRK1 P41145 1/20 0.43
KLF5 Q13887 1/20 0.43
MCL1 Q07820 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL13393449 0.91 MAPT (0.50) MAPTPTGESNPC1RAB9AKMT2A
SCHEMBL16364384 0.90 NPC1 (0.54) MAPTNPSR1PTGESNPC1RAB9A
SCHEMBL16364381 0.88 NPC1 (0.49) MAPTNPSR1PTGESNPC1RAB9A
SCHEMBL1974209 0.87 GAA (0.50) MAPTNPSR1PTGESNPC1RAB9A
SCHEMBL16318424 0.85 RAB9A (0.51) MAPTPTGESNPC1RAB9AKMT2A
SCHEMBL1975192 0.85 NPC1 (0.46) MAPTNPSR1PTGESNPC1RAB9A
SCHEMBL16363593 0.85 KMT2A (0.51) MAPTNPSR1NPC1RAB9AKMT2A
SCHEMBL1973147 0.85 IRAK4 (0.58) MAPTNPSR1NPC1RAB9AKMT2A
SCHEMBL1974207 0.84 NPC1 (0.54) NPSR1NPC1RAB9AKMT2ALCK
SCHEMBL16318503 0.84 RXFP1 (0.50) MAPTPTGESNPC1RAB9AKMT2A

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-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-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
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 US disclosed
EP-2334652-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-06-22 EP disclosed
WO-2010034796-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 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-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents MAPRE2, MAPRE1, H1-4 MAPT 480/4885NPSR1 2508/4885PTGES 118/4885
US-20150011513-A1 ALKYNE-, AZIDE- AND TRIAZOLE-CONTAINING FLAVONOIDS AS MODULATORS FOR MULTIDRUG RESISTANCE IN CANCERS ABCG2, ABCB1, ABCC1 MAPT 3514/4885NPSR1 1871/4885PTGES 3823/4885

“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.