SCHEMBL7561577

SCHEMBL7561577

Cc1cc(NC(=O)Cc2cc(C#N)ccc2OCc2ccccc2)ccc1-n1c(C)c(C)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.42
LMNA P02545 3/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
P2RX4 Q99571 1/20 0.40
ALDH1A1 P00352 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PPIA P62937 1/20 0.38
USP2 O75604 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGER1 P34995 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SLC6A9 P48067 1/20 0.37
PDCD1 Q15116 2/20 0.37
CD274 Q9NZQ7 2/20 0.37
RORC P51449 2/20 0.37
LRRK2 Q5S007 1/20 0.37

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
Hydrochloric Acid SCHEMBL6939201 0.85 F2 (0.41) CYP19A1P2RX4PTGER1
SCHEMBL7127088 0.81 MRGPRX4 (0.49) CYP19A1LMNAMRGPRX4P2RX4ALDH1A1
SCHEMBL7076172 0.80 MEN1 (0.45) CYP19A1LMNAMRGPRX4P2RX4ALDH1A1
SCHEMBL7121876 0.77 ALDH1A1 (0.49) CYP19A1LMNAP2RX4ALDH1A1MAPT
SCHEMBL5099764 0.77 MET (0.46) CYP19A1LMNAMRGPRX4P2RX4ALDH1A1
SCHEMBL7122686 0.77 P2RX4 (0.44) CYP19A1LMNAMRGPRX4P2RX4PPIA
SCHEMBL6937058 0.76 LMNA (0.39) LMNAMRGPRX4P2RX4ALDH1A1NPSR1
SCHEMBL6936342 0.75 GABRA1 (0.38) LMNAMRGPRX4P2RX4MAPTPPIA
SCHEMBL7126958 0.75 MET (0.46) CYP19A1LMNAP2RX4ALDH1A1MAPT
SCHEMBL7562749 0.74 PTGER1 (0.39) CYP19A1LMNAMRGPRX4P2RX4PPIA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020183519-A1 Antithrombotic carboxylic acid amides BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-12-05 US 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 CYP19A1 1031/4885LMNA 1079/4885MRGPRX4 2438/4885

“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.