SCHEMBL4602608

SCHEMBL4602608

CCOc1ccc(-c2cccc(OC)c2F)cc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.53
PTPN11 Q06124 2/20 0.51
KMT2A Q03164 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
CTSA P10619 4/20 0.46
TSHR P16473 1/20 0.46
KCNK3 O14649 1/20 0.44
KCNK9 Q9NPC2 1/20 0.44
ERN1 O75460 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
METAP2 P50579 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
SCHEMBL4601926 0.91 PTPN11 (0.58) DHODHPTPN11MRGPRX4CTSAERN1
SCHEMBL5154645 0.81 TSHR (0.51) PTPN11TSHRERN1
SCHEMBL4600533 0.80 TSHR (0.50) PTPN11KMT2ATSHR
SCHEMBL4602660 0.79 TSHR (0.47) PTPN11KMT2ATSHRERN1
SCHEMBL4603254 0.79 TSHR (0.59) PTPN11KMT2ATSHR
SCHEMBL4600863 0.79 PTPN11 (0.56) PTPN11KMT2ATSHR
SCHEMBL19320833 0.79 TTR (0.60) DHODHPTPN11KMT2ACTSATSHR
SCHEMBL2771810 0.78 CFD (0.61) PTPN11KMT2ATSHR
SCHEMBL4602172 0.78 PTPN11 (0.56) DHODHPTPN11KMT2ACTSATSHR
SCHEMBL4601835 0.78 MCL1 (0.61) PTPN11KMT2ACTSATSHR

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 DHODH 3439/4885PTPN11 3529/4885KMT2A 916/4885

“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.