SCHEMBL4615330

SCHEMBL4615330

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 1/20 0.48
KDM4E B2RXH2 2/20 0.46
APAF1 O14727 1/20 0.46
RECQL P46063 1/20 0.46
CASP6 P55212 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
MCL1 Q07820 1/20 0.46
CASP8 Q14790 1/20 0.46
IDO1 P14902 1/20 0.45
MAPT P10636 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
NEK2 P51955 2/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 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
SCHEMBL4012947 0.90 ALDH1A1 (0.52) CFDKDM4EAPAF1RECQLCASP6
SCHEMBL4602843 0.88 CFD (0.56) CFDKDM4EAPAF1RECQLCASP6
SCHEMBL4601662 0.84 CFD (0.43) CFDKDM4EAPAF1RECQLCASP6
SCHEMBL4600759 0.83 LMNA (0.51) CFDKDM4EAPAF1RECQLCASP6
SCHEMBL4603132 0.81 NEK2 (0.56) CFDKDM4EAPAF1RECQLCASP6
SCHEMBL4600796 0.80 MCL1 (0.57) MCL1MAPTTDP1NEK2ALDH1A1
SCHEMBL4615367 0.80 RXRA (0.58) CFDKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL5149296 0.78 PTPN11 (0.56) CFDKDM4EAPAF1RECQLCASP6
SCHEMBL13958699 0.78 IRAK4 (0.55)
SCHEMBL2769498 0.78 CFD (0.67) 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 CFD 1224/4885KDM4E 2399/4885APAF1 1688/4885

“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.