SCHEMBL7562749

SCHEMBL7562749

Cc1cc(NC(=O)Cc2cc(C#N)ccc2OCc2ccccc2)ccc1-n1nc(CN(C)C)c2c1CCC2

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 6/20 0.39
CYP19A1 P11511 1/20 0.38
P2RX4 Q99571 1/20 0.37
CSF1R P07333 1/20 0.36
MET P08581 1/20 0.36
PPIA P62937 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
LMNA P02545 1/20 0.35
MCHR1 Q99705 2/20 0.35

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
SCHEMBL6936342 0.88 GABRA1 (0.38) PTGER1P2RX4CSF1RMETPPIA
SCHEMBL6942080 0.80 RORC (0.40) PTGER1CYP19A1P2RX4METPPIA
SCHEMBL7076172 0.76 MEN1 (0.45) PTGER1CYP19A1P2RX4PPIAMRGPRX4
SCHEMBL7561698 0.75 RORC (0.41) PTGER1CYP19A1P2RX4CSF1RPPIA
SCHEMBL7127088 0.75 MRGPRX4 (0.49) CYP19A1P2RX4METPPIAMRGPRX4
SCHEMBL5099764 0.74 MET (0.46) CYP19A1P2RX4METPPIAMRGPRX4
SCHEMBL7561577 0.74 CYP19A1 (0.42) PTGER1CYP19A1P2RX4PPIAMRGPRX4
SCHEMBL7121876 0.73 ALDH1A1 (0.49) CYP19A1P2RX4LMNA
SCHEMBL7562213 0.72 MAPT (0.35) CSF1RLMNA
SCHEMBL7122686 0.71 P2RX4 (0.44) PTGER1CYP19A1P2RX4METPPIA

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 PTGER1 299/4885CYP19A1 1031/4885P2RX4 1710/4885

“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.