SCHEMBL6030231

SCHEMBL6030231

O=C(NC(Cc1ccccc1)C(=O)O)c1ccc(-c2ccc(OCc3cccc(F)c3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR34 Q9UPC5 8/20 0.70
GPR132 Q9UNW8 7/20 0.63
GRM5 P41594 1/20 0.61
NR4A2 P43354 1/20 0.59
CMKLR2 P46091 1/20 0.55
CMKLR1 Q99788 1/20 0.55
MAOB P27338 2/20 0.55
PARP10 Q53GL7 1/20 0.55
PTPN2 P17706 1/20 0.54
PTPN1 P18031 1/20 0.54
CDC25B P30305 1/20 0.54

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
SCHEMBL6029879 0.89 GPR34 (0.77) GPR34GPR132PTPN1
SCHEMBL6029880 0.89 GPR132 (0.73) GPR34GPR132PTPN1
SCHEMBL5921797 0.89 GPR132 (0.68) GPR34GPR132GRM5NR4A2CMKLR2
SCHEMBL6030288 0.89 GPR34 (0.64) GPR34GPR132MAOBPTPN2PTPN1
SCHEMBL5921793 0.89 GPR132 (0.68) GPR34GPR132GRM5NR4A2CMKLR2
SCHEMBL5927205 0.88 GPR132 (0.72) GPR34GPR132PTPN1
SCHEMBL1123243 0.88 GPR132 (0.72) GPR34GPR132PTPN1
SCHEMBL1122833 0.88 GPR132 (0.72) GPR34GPR132PTPN1
SCHEMBL6030407 0.88 GPR34 (0.70) GPR34GPR132CMKLR2CMKLR1MAOB
SCHEMBL6029557 0.88 GPR132 (0.63) GPR34GPR132CMKLR2CMKLR1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060247260-A1 Bis (hetero) aryl carboxamide derivatives for use as PG12 antagonists BAYER HEALTHCARE AG (DE) 2006-11-02 US claimed
EP-1594846-A1 BIS(HETERO)ARYL CARBOXAMIDE DERIVATIVES FOR USE AS PGI2 ANTAGONISTS Bayer HealthCare AG (DE) 2005-11-16 EP claimed
WO-2004069805-A1 BIS(HETERO)ARYL CARBOXAMIDE DERIVATIVES FOR USE AS PGI2 ANTAGONISTS BAYER HEALTHCARE AG (DE) 2004-08-19 WO claimed
US-20060247260-A1 Bis (hetero) aryl carboxamide derivatives for use as PG12 antagonists BAYER HEALTHCARE AG (DE) 2006-11-02 US disclosed
EP-1594846-A1 BIS(HETERO)ARYL CARBOXAMIDE DERIVATIVES FOR USE AS PGI2 ANTAGONISTS Bayer HealthCare AG (DE) 2005-11-16 EP disclosed
WO-2004069805-A1 BIS(HETERO)ARYL CARBOXAMIDE DERIVATIVES FOR USE AS PGI2 ANTAGONISTS BAYER HEALTHCARE AG (DE) 2004-08-19 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-20060247260-A1 Bis (hetero) aryl carboxamide derivatives for use as PG12 antagonists HRH2, BPHL, HRH1 GPR34 426/4885GPR132 68/4885GRM5 799/4885

“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.