SCHEMBL7076172

SCHEMBL7076172

Cc1cc(NC(=O)Cc2cc(C#N)ccc2OCc2ccccc2)ccc1-n1cnc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
IKBKE Q14164 1/20 0.44
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PLK1 P53350 2/20 0.41
CYP19A1 P11511 1/20 0.41
LMNA P02545 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
PPIA P62937 1/20 0.40
XDH P47989 1/20 0.40
ALDH1A1 P00352 2/20 0.40
DUSP3 P51452 1/20 0.40
P2RX4 Q99571 1/20 0.40
PTGER1 P34995 1/20 0.39
USP2 O75604 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ADRA2B P18089 1/20 0.39

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
SCHEMBL7127088 0.81 MRGPRX4 (0.49) CYP19A1LMNAMRGPRX4PPIAALDH1A1
SCHEMBL6937058 0.80 LMNA (0.39) HTTSMN1; SMN2LMNAMRGPRX4PPIA
SCHEMBL7561577 0.80 CYP19A1 (0.42) SMN1; SMN2CYP19A1LMNAMRGPRX4PPIA
SCHEMBL5099764 0.77 MET (0.46) CYP19A1LMNAMRGPRX4PPIAALDH1A1
SCHEMBL6936342 0.77 GABRA1 (0.38) LMNAMRGPRX4PPIAP2RX4PTGER1
SCHEMBL7122686 0.77 P2RX4 (0.44) CYP19A1LMNAMRGPRX4PPIAP2RX4
SCHEMBL7121876 0.76 ALDH1A1 (0.49) MEN1KMT2AHTTSMN1; SMN2CYP19A1
SCHEMBL7562749 0.76 PTGER1 (0.39) CYP19A1LMNAMRGPRX4PPIAP2RX4
SCHEMBL7121896 0.75 SGMS2 (0.46) CYP19A1MRGPRX4PPIAPTGER1
SCHEMBL6942080 0.74 RORC (0.40) CYP19A1LMNAMRGPRX4PPIAP2RX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

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-20020183519-A1 Antithrombotic carboxylic acid amides SERPINC1, TFPI, F2 MEN1 2312/4885KMT2A 332/4885IKBKE 756/4885

“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.