SCHEMBL6700544

SCHEMBL6700544

N#Cc1ccc(Cc2ccccc2C(=O)O)c(NC(=O)C(CC2CC2)c2cccc3ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 4/20 0.53
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
XIAP P98170 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CDK2 P24941 1/20 0.35
SLC16A3 O15427 1/20 0.35
CCR3 P51677 4/20 0.35
HTT P42858 1/20 0.34
GFER P55789 1/20 0.34
GAA P10253 1/20 0.34
ROCK2 O75116 1/20 0.34

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
SCHEMBL6699480 0.88 PTGER4 (0.68) PTGER4MEN1KMT2AKDM4ELMNA
SCHEMBL5352209 0.86 PTGER4 (0.59) PTGER4XIAPMEN1KMT2AKDM4E
SCHEMBL5352243 0.86 PTGER4 (0.58) PTGER4XIAPMEN1KMT2AKDM4E
SCHEMBL5352224 0.86 PTGER4 (0.58) PTGER4XIAPMEN1KMT2AKDM4E
SCHEMBL6339165 0.85 PTGER4 (0.47) PTGER4
SCHEMBL5350571 0.84 PTGER4 (0.75) PTGER4XIAPMEN1KMT2AKDM4E
SCHEMBL6700959 0.84 PTGER4 (0.66) PTGER4MEN1KMT2AKDM4ELMNA
SCHEMBL5351605 0.79 PTGER4 (0.49) PTGER4XIAPMEN1KMT2AKDM4E
SCHEMBL5352233 0.78 PTGER4 (0.49) PTGER4XIAPROCK2
SCHEMBL6710706 0.76 PTGER4 (0.46) PTGER4

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
US-20040002493-A1 Benzoic acid derivatives and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-01-01 US claimed
EP-1314719-A1 BENZOIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2003-05-28 EP claimed
US-20040002493-A1 Benzoic acid derivatives and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-01-01 US disclosed
EP-1314719-A1 BENZOIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2003-05-28 EP 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-20040002493-A1 Benzoic acid derivatives and pharmaceutical agents comprising the same as active ingredient PTGER1, PTGER4, PTGES PTGER4 2/4885DRD2 1172/4885DRD3 1556/4885

“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.