SCHEMBL4603310

SCHEMBL4603310

CCCOc1ccc(-c2cccc(CO)c2)cc1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 6/20 0.67
ACMSD Q8TDX5 3/20 0.59
PTPN1 P18031 1/20 0.55
PTPN6 P29350 1/20 0.55
PTGER4 P35408 4/20 0.48
DHODH Q02127 1/20 0.48
BCL2 P10415 1/20 0.45
CFD P00746 1/20 0.44
S1PR3 Q99500 2/20 0.44
S1PR1 P21453 1/20 0.44
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL4601902 0.90 ACMSD (0.62) PTPN11ACMSDPTPN1PTPN6PTGER4
SCHEMBL14610583 0.89 PTPN11 (0.54) PTPN11ACMSDPTPN1PTPN6PTGER4
SCHEMBL4603006 0.88 PTPN11 (0.65) PTPN11ACMSDPTPN1PTPN6CFD
SCHEMBL4601726 0.87 PTPN11 (0.68) PTPN11ACMSDPTPN1PTPN6CFD
SCHEMBL4601658 0.86 PTPN11 (0.67) PTPN11ACMSDPTPN1PTPN6CFD
SCHEMBL4600493 0.85 PTPN11 (0.62) PTPN11ACMSDPTPN1PTPN6BCL2
SCHEMBL4601762 0.84 PTPN11 (0.65) PTPN11PTPN1PTPN6DHODHCFD
SCHEMBL4602661 0.84 PTPN11 (0.65) PTPN11ACMSDPTPN1PTPN6DHODH
SCHEMBL4600952 0.84 PTPN11 (0.85) PTPN11PTPN1PTPN6S1PR3
SCHEMBL4600995 0.84 PTPN11 (0.65) PTPN11PTPN1PTPN6DHODH

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 PTPN11 3529/4885ACMSD 1330/4885PTPN1 3489/4885

“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.