SCHEMBL10083804

SCHEMBL10083804

CCOC(=O)c1cc(OC)ccc1C=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.60
▸ KDM4E B2RXH2 6/20 0.60
▸ HPGD P15428 5/20 0.60
▸ TRIM24 O15164 1/20 0.53
▸ TYR P14679 1/20 0.53
▸ TRIM33 Q9UPN9 1/20 0.53
▸ MAOB P27338 2/20 0.51
▸ CA12 O43570 2/20 0.51
▸ CA2 P00918 2/20 0.51
▸ CA7 P43166 2/20 0.51
▸ CA9 Q16790 2/20 0.51
▸ CA14 Q9ULX7 2/20 0.51
▸ GLA P06280 1/20 0.51
▸ CA3 P07451 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ CA4 P22748 1/20 0.51
▸ CA6 P23280 1/20 0.51
▸ ERN1 O75460 2/20 0.49
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48

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
SCHEMBL4476198 0.84 TRIM24 (0.59) ALDH1A1KDM4EHPGDTRIM24TYR
SCHEMBL6864395 0.83 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDMAOBCA12
SCHEMBL28275232 0.82 HPGD (0.60) ALDH1A1KDM4EHPGDMAOBCA12
SCHEMBL28475992 0.81 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDMAOBCA12
SCHEMBL3481145 0.81 HPGD (0.58) ALDH1A1KDM4EHPGDMAOBCA12
SCHEMBL7391428 0.80 TRIM24 (0.44) ALDH1A1KDM4EHPGDTRIM24TYR
SCHEMBL13469248 0.80 HPGD (0.57) ALDH1A1KDM4EHPGDMAOBCA12
SCHEMBL29191709 0.80 MEN1 (0.62) ALDH1A1KDM4EHPGDMAOBCA12
SCHEMBL2709952 0.80 CA12 (0.73) ALDH1A1KDM4EHPGDMAOBCA12
SCHEMBL13329535 0.79 TRIM24 (0.61) ALDH1A1KDM4EHPGDTRIM24TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2632915-B1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INT (DE) 2015-08-12 — — EP disclosed
US-8829200-B2 Benzimidazole inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-09 — — US disclosed
US-8829200-B2 Benzimidazole inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-09 — — US disclosed
US-20120277226-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-01 — — US disclosed
US-20120277226-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-01 — — US disclosed
WO-2012058254-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 — — 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-20120277226-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION LTB4R, LTB4R2, LTC4S ALDH1A1 371/4885KDM4E 2486/4885HPGD 377/4885

“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.

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