SCHEMBL4602218

SCHEMBL4602218

COc1cc(-c2ccc(OCC=C(C)C)c(C(=O)O)c2)cc(OC)c1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.51
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
PTGES O14684 4/20 0.46
CFD P00746 1/20 0.46
MGAM O43451 1/20 0.45
GAA P10253 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
TRPA1 O75762 1/20 0.44
MTNR1A P48039 1/20 0.44
KDM4E B2RXH2 1/20 0.44
APAF1 O14727 1/20 0.44
RECQL P46063 1/20 0.44
CASP6 P55212 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
MCL1 Q07820 1/20 0.44

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
SCHEMBL4603132 0.83 NEK2 (0.56) CFDKDM4EAPAF1RECQLCASP6
SCHEMBL4602843 0.83 CFD (0.56) CFDGAAKDM4EAPAF1RECQL
SCHEMBL5149296 0.81 PTPN11 (0.56) PDE4APDE4BPDE4CPDE4DCFD
SCHEMBL28948110 0.79 KDM4E (0.54) ALOX5PTGESGAATRPA1MTNR1A
SCHEMBL30293692 0.79 KDM4E (0.54) ALOX5PTGESGAATRPA1MTNR1A
SCHEMBL14512026 0.79 MGAM (0.70) PDE4APDE4BPDE4CPDE4DMGAM
SCHEMBL6653354 0.78 TPMT (0.54) ALOX5PDE4BPTGESGAATRPA1
SCHEMBL4600813 0.76 PTGES (0.52) PDE4APDE4BPDE4CPDE4DPTGES
SCHEMBL6652397 0.76 ALOX5 (0.53) ALOX5PTGESGAATRPA1MTNR1A
SCHEMBL4615330 0.76 CFD (0.48) CFDKDM4EAPAF1RECQLCASP6

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
EP-1912970-A2 ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL Bayer Schering Pharma Aktiengesellschaft (DE) 2008-04-23 EP claimed
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US claimed
WO-2007017289-A2 ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-02-15 WO claimed
EP-1912970-A2 ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL Bayer Schering Pharma Aktiengesellschaft (DE) 2008-04-23 EP disclosed
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US disclosed
WO-2007017289-A2 ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-02-15 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-20070060573-A1 Acyltryptophanols FSHR, NPY1R, NPY2R ALOX5 723/4885PDE4A 1576/4885PDE4B 1807/4885

“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.