SCHEMBL1154792

SCHEMBL1154792

COc1ccc(Cl)cc1C(=O)NCCc1cc(Cl)c(-c2ccc(C(=O)O)cc2)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DNMT3A Q9Y6K1 1/20 0.62
HDAC1 Q13547 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
NLRP3 Q96P20 3/20 0.57
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53

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
Meglitinide SCHEMBL37926 0.88 DNMT3A (0.78) DNMT3AHDAC1HDAC6NLRP3GAA
Meglitinide SCHEMBL29829482 0.88 DNMT3A (0.78) DNMT3AHDAC1HDAC6NLRP3GAA
SCHEMBL1153776 0.85 DNMT3A (0.67) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL1154562 0.85 ALDH1A1 (0.56) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL13884679 0.81 DNMT3A (0.54) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL10305291 0.81 DNMT3A (0.64) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL3655099 0.81 DNMT3A (0.77) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL1154026 0.80 DNMT3A (0.69) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL3784241 0.80 DNMT3A (0.80) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL11445616 0.80 DNMT3A (0.71) DNMT3AHDAC1HDAC6NLRP3LMNA

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
US-8299123-B2 CCR10 antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-10-30 US disclosed
US-8299123-B2 CCR10 antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-10-30 US disclosed
EP-2215065-B1 CCR10 ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2012-07-11 EP disclosed
EP-2215065-B1 CCR10 ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2012-07-11 EP disclosed
US-20110039851-A1 CCR10 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-17 US disclosed
US-20110039851-A1 CCR10 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-17 US disclosed
US-20110039851-A1 CCR10 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-17 US disclosed
EP-2215065-A1 CCR10 ANTAGONISTS Boehringer Ingelheim International GmbH (DE) 2010-08-11 EP disclosed
WO-2009052078-A1 CCR10 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-23 WO disclosed
WO-2009052078-A1 CCR10 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-23 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-20110039851-A1 CCR10 ANTAGONISTS CCR10, CCR1, CCR4 DNMT3A 4688/4885HDAC1 722/4885HDAC6 495/4885

“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.