SCHEMBL3070467

SCHEMBL3070467

NC(=O)c1nc2cc(Cl)c(Cl)cc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 2/20 0.57
▸ GRIN2D O15399 2/20 0.53
▸ GRIN3B O60391 2/20 0.53
▸ GRIA1 P42261 2/20 0.53
▸ GRIA2 P42262 2/20 0.53
▸ GRIA3 P42263 2/20 0.53
▸ GRIA4 P48058 2/20 0.53
▸ GRIN1 Q05586 2/20 0.53
▸ GRIN2A Q12879 2/20 0.53
▸ GRIN2B Q13224 2/20 0.53
▸ GRIN2C Q14957 2/20 0.53
▸ GRIN3A Q8TCU5 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ GRIK1 P39086 1/20 0.53
▸ GRIK2 Q13002 1/20 0.53
▸ GRIK3 Q13003 1/20 0.53
▸ GRIK4 Q16099 1/20 0.53
▸ GRIK5 Q16478 1/20 0.53
▸ PRKAG1 P54619 6/20 0.50
▸ PRKAA2 P54646 6/20 0.50

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
SCHEMBL4309662 0.84 EGLN1 (0.63) EGLN1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL1258540 0.82 EGLN1 (0.57) EGLN1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL29414225 0.79 KMT2A (0.46) CHEK2RHEB
SCHEMBL7152026 0.79 HTR3E (0.57) CHEK2F10
SCHEMBL3064168 0.79 KMT2A (0.46) CHEK2RHEB
SCHEMBL416845 0.79 FABP6 (0.55) EGLN1LMNACHEK2F10
SCHEMBL1259264 0.78 EGLN1 (0.54) EGLN1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL9703926 0.78 GRIN2D (0.74) EGLN1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL9589724 0.78 EGLN1 (0.41) EGLN1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL4239948 0.74 MAPKAPK2 (0.47) LMNAGAAHTTCHEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2742029-B1 N-(BENZIMIMDAZOL-2-YL)-CYCLOPROPANE CARBOXAMIDES AS LYSOPHOSPHATIDIC ACID ANTAGONISTS MERCK PATENT GMBH (DE) 2016-10-05 — — EP disclosed
US-8912202-B2 N-(benzimimdazol-2-yl)-cyclopropane carboxamides as lysophosphatidic acid antagonists MERCK PATENT GMBH (DE) 2014-12-16 — — US disclosed
US-20140228378-A1 N-(Benzimimdazol-2-yl)-Cyclopropane Carboxamides as Lysophosphatidic Acid Antagonists MERCK PATENT GMBH (DE) 2014-08-14 — — US disclosed
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 — — US disclosed
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 — — US disclosed
US-20100267717-A1 Novel Heterocyclic NF-kB Inhibitors 4SC AG (DE) 2010-10-21 — — US disclosed
US-20100048574-A1 NOVEL HETEROCYCLIC NF-kB INHIBITORS 4SC AG (DE) 2010-02-25 — — US disclosed
US-20100004258-A1 Novel Heterocyclic NF-kB Inhibitors 4SC AG (DE) 2010-01-07 — — US disclosed
US-7601745-B2 Heterocyclic NF-kB inhibitors 4SC AG (DE) 2009-10-13 — — US disclosed
US-20060247253-A1 Novel heterocyclic NF-kB inhibitors 4 SC AG (DE) 2006-11-02 — — US 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 (6 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-20100267717-A1 Novel Heterocyclic NF-kB Inhibitors NFKB2, NFKBIA, NFRKB EGLN1 2945/4885GRIN2D 2512/4885GRIN3B 1344/4885
US-20140228378-A1 N-(Benzimimdazol-2-yl)-Cyclopropane Carboxamides as Lysophosphatidic Acid Antagonists LPAR5, LPAR2, LPAR1 EGLN1 1145/4885GRIN2D 4355/4885GRIN3B 4774/4885
US-20100048574-A1 NOVEL HETEROCYCLIC NF-kB INHIBITORS NFKBIA, IKBKB, NFKB2 EGLN1 2162/4885GRIN2D 3926/4885GRIN3B 3111/4885
US-20060247253-A1 Novel heterocyclic NF-kB inhibitors NFKBIA, NFRKB, NFKB2 EGLN1 2847/4885GRIN2D 3223/4885GRIN3B 1033/4885
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 EGLN1 1893/4885GRIN2D 1017/4885GRIN3B 438/4885
US-20100004258-A1 Novel Heterocyclic NF-kB Inhibitors NFKBIA, IKBKB, NFKB2 EGLN1 2105/4885GRIN2D 4226/4885GRIN3B 2485/4885

“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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