SCHEMBL4601436

SCHEMBL4601436

CCCOc1ccc(-c2ccc(F)c(F)c2)cc1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.59
PTPN1 P18031 1/20 0.55
PTPN6 P29350 1/20 0.55
RARB P10826 3/20 0.50
RARA P10276 2/20 0.50
MCL1 Q07820 1/20 0.48
CFD P00746 1/20 0.48
S1PR3 Q99500 1/20 0.46
RARG P13631 1/20 0.45
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
LCLAT1 Q6UWP7 1/20 0.41
PTGER2 P43116 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41

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
SCHEMBL4602854 0.90 PTPN11 (0.57) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL4600768 0.89 PTPN11 (0.56) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL4601086 0.89 PTPN11 (0.56) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL4601983 0.88 PTPN11 (0.55) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL14610787 0.88 PTPN11 (0.45) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL4601679 0.87 PTPN11 (0.64) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL4601640 0.86 PTPN11 (0.59) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL4601516 0.85 PTPN11 (0.52) PTPN11PTPN1PTPN6RARBRARA
SCHEMBL5149252 0.85 PTPN11 (0.52) PTPN11PTPN1PTPN6MCL1
SCHEMBL4601206 0.84 PTPN11 (0.64) PTPN11PTPN1PTPN6CFDS1PR3

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.