SCHEMBL756150

SCHEMBL756150

CC(=O)c1ccc(Oc2ccc(Cl)cc2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
HPGD P15428 1/20 0.53
RAB9A P51151 1/20 0.53
SCN9A Q15858 7/20 0.51
FPR2 P25090 2/20 0.48
IGFBP3 P17936 1/20 0.48
MAOB P27338 4/20 0.47
MAOA P21397 3/20 0.47
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PTGER4 P35408 1/20 0.45
PTGER2 P43116 1/20 0.45
PARP10 Q53GL7 1/20 0.44
ESRRA P11474 1/20 0.44

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
SCHEMBL1283828 0.84 FFAR1 (0.57) MAPTHPGDRAB9AMAOBMAOA
SCHEMBL30356696 0.84 MAOB (0.58) MAPTHPGDRAB9AMAOBMAOA
SCHEMBL11548018 0.84 MAOB (0.58) MAPTHPGDRAB9AMAOBMAOA
SCHEMBL11544485 0.84 SCN9A (0.46) SCN9AFPR2IGFBP3LMNASMN1; SMN2
SCHEMBL753409 0.82 SCN9A (0.44) MAPTHPGDSCN9AFPR2IGFBP3
SCHEMBL2544053 0.82 SCN9A (0.44) MAPTHPGDSCN9AFPR2IGFBP3
SCHEMBL2964396 0.82 MAPT (0.66) MAPTHPGDRAB9AMAOBMAOA
SCHEMBL9762032 0.82 MAPT (0.53) MAPTHPGDRAB9AIGFBP3MAOB
SCHEMBL11540797 0.82 SCN9A (0.46) SCN9AFPR2IGFBP3LMNASMN1; SMN2
SCHEMBL3366867 0.81 ALDH1A1 (0.55) MAPTHPGDRAB9AIGFBP3MAOB

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-8916589-B2 Bradykinin B1-antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-12-23 US disclosed
EP-2188254-B1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2012-03-21 EP disclosed
US-20110263626-A1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-27 US disclosed
EP-2188254-A1 NOVEL BRADYKININ B1-ANTAGONISTS Boehringer Ingelheim International GmbH (DE) 2010-05-26 EP disclosed
WO-2009027450-A1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-03-05 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-20110263626-A1 NOVEL BRADYKININ B1-ANTAGONISTS BDKRB1, BDKRB2, EDNRB MAPT 3258/4885HPGD 587/4885RAB9A 2107/4885

“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.