SCHEMBL1967897

SCHEMBL1967897

Cc1cc(N)c([N+](=O)[O-])cc1C(=O)Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
TSHR P16473 5/20 0.46
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 3/20 0.42
RECQL P46063 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 4/20 0.41
MAPT P10636 4/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
ALOX15 P16050 1/20 0.41
PDGFRB P09619 1/20 0.40
FGFR1 P11362 1/20 0.40
PDGFRA P16234 1/20 0.40
FLT1 P17948 1/20 0.40
FGFR3 P22607 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
SCHEMBL773100 0.86 TSHR (0.47) LMNATSHRALDH1A1CYP3A4RECQL
SCHEMBL1964637 0.85 LMNA (0.56) LMNATSHRALDH1A1CYP3A4RECQL
SCHEMBL11404100 0.84 TSHR (0.50) TSHRALDH1A1CYP3A4RECQLMAPT
SCHEMBL1965843 0.81 ALDH1A1 (0.53) LMNATSHRALDH1A1CYP3A4MAPK1
SCHEMBL8092545 0.81 TSHR (0.50) TSHRALDH1A1CYP3A4RECQLCYP1A2
SCHEMBL13086024 0.81 SLC6A2 (0.44) LMNATSHRALDH1A1CYP3A4RECQL
SCHEMBL13516231 0.81 PDGFRB (0.62) LMNATSHRALDH1A1MAPTPOLB
SCHEMBL1967460 0.80 LMNA (0.42) LMNATSHRALDH1A1CYP3A4MAPK1
SCHEMBL27011416 0.80 TSHR (0.46) LMNATSHRALDH1A1CYP3A4RECQL
Hydrochloric Acid SCHEMBL29119779 0.79 TSHR (0.45) LMNATSHRALDH1A1CYP3A4RECQL

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 5 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 disclosed
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 US disclosed
CN-102224143-A 1h-benzimidazole-5-carboxamides as anti-inflammatory agents BOEHRINGER INGELHEIM INT 2011-10-19 CN 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 LMNA 2823/4885TSHR 3325/4885ALDH1A1 1202/4885

“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.