SCHEMBL1971802

SCHEMBL1971802

Cn1c(Nc2c(Cl)cncc2Cl)nc2cc(C(=O)O)ccc21

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 6/20 0.52
HCAR3 P49019 3/20 0.44
HSD17B10 Q99714 1/20 0.42
HTT P42858 1/20 0.41
HPGD P15428 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
EHMT2 Q96KQ7 1/20 0.41
EHMT1 Q9H9B1 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
IDH1 O75874 1/20 0.41
NAMPT P43490 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
BCL6 P41182 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
SCHEMBL1965470 0.89 HDAC6 (0.56) HDAC6HCAR3HSD17B10HTTEHMT2
SCHEMBL1974190 0.88 HDAC6 (0.47) HDAC6EHMT2CSNK2A2CSNK2BCSNK2A1
SCHEMBL1970441 0.83 TP53 (0.53) HDAC6HPGDNPC1
SCHEMBL3698616 0.82 HDAC6 (0.54) HDAC6NAMPTNPC1RAB9A
SCHEMBL3705491 0.80 PTGES (0.48) HDAC6HPGDIDH1NPC1
SCHEMBL1970364 0.80 HDAC6 (0.57) HDAC6HCAR3HSD17B10HTTHPGD
SCHEMBL1964946 0.79 HDAC6 (0.56) HDAC6HCAR3HSD17B10HTTEHMT2
SCHEMBL3120843 0.79 CSNK2A2 (0.47) HDAC6CSNK2A2CSNK2BCSNK2A1
SCHEMBL6320502 0.77 HDAC6 (0.53) HDAC6HCAR3HSD17B10HTTHPGD
SCHEMBL16318619 0.77 HDAC6 (0.51) HDAC6EHMT2IDH1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040565-B2 1H-benzimidazole-5-carboxamides as anti-inflammatory agents OREXO AB (SE) 2015-05-26 US disclosed
US-20120122930-A1 1H-Benzimidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-17 US disclosed
EP-2334664-A1 1H-BENZIMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-06-22 EP disclosed
WO-2010034797-A1 1H-BENZIMIDAZOLE-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-20120122930-A1 1H-Benzimidazole-5-Carboxamides As Anti-Inflammatory Agents MAPRE2, MAPRE1, MAP4 HDAC6 208/4885HCAR3 732/4885HSD17B10 4473/4885

“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.