SCHEMBL4601299

SCHEMBL4601299

CCCOc1ccc(-c2cccc(C(F)(F)F)c2)cc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.60
PTPN1 P18031 1/20 0.50
PTPN6 P29350 1/20 0.50
PPARD Q03181 7/20 0.49
PPARA Q07869 4/20 0.49
MRGPRX4 Q96LA9 2/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.45
KIFC1 Q9BW19 1/20 0.45
MCL1 Q07820 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
CTSA P10619 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
SCHEMBL4601749 0.90 RXRA (0.56) PTPN11PTPN1PTPN6PPARDPPARA
SCHEMBL4601854 0.90 PTPN11 (0.53) PTPN11PPARDPPARAMRGPRX4PTGDR2
SCHEMBL4602156 0.89 PTPN11 (0.60) PTPN11PTPN1PTPN6PPARDPPARA
SCHEMBL4599953 0.85 PTPN11 (0.57) PTPN11PTPN1PTPN6RXRARXRB
SCHEMBL4601726 0.84 PTPN11 (0.68) PTPN11PTPN1PTPN6MRGPRX4MCL1
SCHEMBL4601658 0.84 PTPN11 (0.67) PTPN11PTPN1PTPN6MCL1
SCHEMBL4602266 0.84 PTPN11 (0.64) PTPN11PTPN1PTPN6MCL1
SCHEMBL4601762 0.82 PTPN11 (0.65) PTPN11PTPN1PTPN6MCL1
SCHEMBL4602661 0.82 PTPN11 (0.65) PTPN11PTPN1PTPN6MCL1
SCHEMBL4600952 0.82 PTPN11 (0.85) PTPN11PTPN1PTPN6PPARDPPARA

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 3529/4885PTPN1 3489/4885PTPN6 4028/4885

“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.