SCHEMBL6555871

SCHEMBL6555871

Cc1c(C#N)ccc(OCc2ccccc2)c1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.47
MAOB P27338 1/20 0.45
XDH P47989 2/20 0.42
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL1534077 0.74 XDH (0.55) MAOBXDHMAPTTDP1L3MBTL1
SCHEMBL1534113 0.70 XDH (0.48) MAOBXDHMAPTTDP1L3MBTL1
SCHEMBL5027005 0.69 BRD4 (0.46) MAOBXDHMAPK1
SCHEMBL21884506 0.68 XDH (0.47) MAOBXDHMAPTTDP1L3MBTL1
SCHEMBL15831939 0.68 MAOB (0.56) MAOBXDHMAPTMAPK1TDP1
SCHEMBL8874712 0.68 SGMS2 (0.52) MAOBMAPTMAPK1TDP1L3MBTL1
SCHEMBL10822615 0.68 MAOB (0.59) MAOBXDHMAPTL3MBTL1
SCHEMBL27386521 0.67 SCN2A (0.45) HTT
SCHEMBL6555869 0.67 MAOB (0.46) GRM5MAOB
SCHEMBL448079 0.67 MAOB (0.57) MAOBXDHMAPTMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1390357-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-02-25 EP disclosed
US-20020183519-A1 Antithrombotic carboxylic acid amides BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-12-05 US disclosed
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 US disclosed
WO-2002062778-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-08-15 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 (2 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-20020183519-A1 Antithrombotic carboxylic acid amides SERPINC1, TFPI, F2 GRM5 2870/4885MAOB 743/4885XDH 292/4885
US-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 GRM5 1584/4885MAOB 815/4885XDH 1452/4885

“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.