SCHEMBL6554874

SCHEMBL6554874

N#Cc1ccc(OCc2ccccc2)c(CO)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.55
MRGPRX4 Q96LA9 5/20 0.50
ELANE P08246 4/20 0.50
F2 P00734 1/20 0.50
PTGDR2 Q9Y5Y4 1/20 0.47
PTGER1 P34995 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CTSG P08311 1/20 0.46
USP28 Q96RU2 1/20 0.44
USP25 Q9UHP3 1/20 0.44
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
PPIA P62937 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
SCHEMBL6477203 0.88 MAOB (0.55) MAOBMRGPRX4ELANEF2PTGDR2
SCHEMBL1978691 0.85 MAOB (0.55) MAOBMRGPRX4PTGDR2PTGER1HPGD
SCHEMBL6219199 0.85 ELANE (0.50) MAOBELANEF2PTGER1KDM4E
SCHEMBL8409660 0.85 HTR1A (0.59) MAOBMRGPRX4PTGER1KDM4EALDH1A1
SCHEMBL8676493 0.85 MAOB (0.55) MAOBMRGPRX4PTGDR2PTGER1KDM4E
SCHEMBL6212565 0.85 MAOB (0.55) MAOBMRGPRX4PTGER1HTR1ADRD2
SCHEMBL5089130 0.85 MRGPRX4 (0.53) MAOBMRGPRX4ELANEF2PTGDR2
Hydrochloric Acid SCHEMBL5098921 0.83 MRGPRX4 (0.52) MAOBMRGPRX4ELANEF2PTGDR2
SCHEMBL1400322 0.83 MAOB (0.53) MAOBMRGPRX4PTGER1KDM4EALDH1A1
SCHEMBL5098912 0.82 MRGPRX4 (0.54) MAOBMRGPRX4PTGDR2PTGER1PPIA

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 9 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
EP-1370540-A1 ANTI-THROMBOTIC CARBOXYLIC ACID AMIDES, THE PRODUCTION THEREOF AND USE OF THE SAME AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2003-12-17 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-2002072558-A1 ANTI-THROMBOTIC CARBOXYLIC ACID AMIDES, THE PRODUCTION THEREOF AND USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-09-19 WO 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
US-5811459-A PAIN RELIEVERS ZENECA LIMITED (GB) 1998-09-22 US disclosed
EP-0733033-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-09-25 EP disclosed
WO-1996011902-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-04-25 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 MAOB 743/4885MRGPRX4 2438/4885ELANE 70/4885
US-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 MAOB 815/4885MRGPRX4 2050/4885ELANE 188/4885

“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.