SCHEMBL1971773

SCHEMBL1971773

Cn1c(Nc2c(Cl)cccc2Cl)nc2cc(C(=O)Nc3cccc(Cl)c3)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.56
POLB P06746 1/20 0.56
GAA P10253 1/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
PTGES O14684 1/20 0.51
ALDH1A1 P00352 3/20 0.51
NAMPT P43490 2/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
RECQL P46063 1/20 0.48
LCK P06239 1/20 0.47
KDR P35968 1/20 0.47

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
SCHEMBL1968998 0.91 HDAC6 (0.65) HDAC6GAANPC1RAB9AALDH1A1
SCHEMBL1970553 0.87 MEN1 (0.59) HDAC6NPC1RAB9AALDH1A1NAMPT
SCHEMBL16352204 0.86 ADORA2A (0.53) POLBPTGESALDH1A1MEN1KMT2A
SCHEMBL1972328 0.86 HDAC6 (0.55) HDAC6NPC1RAB9APTGESNAMPT
SCHEMBL1971451 0.85 HDAC6 (0.48) HDAC6GAANPC1RAB9ANAMPT
SCHEMBL1973400 0.84 HDAC6 (0.50) HDAC6NPC1RAB9AALDH1A1NAMPT
SCHEMBL1964849 0.84 PTGES (0.46) POLBGAANPC1RAB9APTGES
SCHEMBL16318704 0.83 RAB9A (0.55) HDAC6POLBNPC1RAB9AALDH1A1
SCHEMBL1972073 0.83 GRM5 (0.52) HDAC6POLBNPC1RAB9ANAMPT
SCHEMBL16352214 0.82 NPC1 (0.55) HDAC6NPC1RAB9AKMT2ASMN1; SMN2

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
EP-2334652-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-06-22 EP claimed
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 (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-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents MAPRE2, MAPRE1, H1-4 HDAC6 177/4885POLB 3740/4885GAA 2503/4885

“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.