SCHEMBL4602625

SCHEMBL4602625

CCOc1ccc(-c2ccc(C)c(Cl)c2)cc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.49
CFD P00746 1/20 0.48
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PTPN1 P18031 1/20 0.46
PTPN6 P29350 1/20 0.46
KMO O15229 2/20 0.46
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
MITF O75030 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
MCL1 Q07820 2/20 0.43
KMT2A Q03164 1/20 0.43
IDO1 P14902 1/20 0.43
LMNA P02545 1/20 0.43
ERN1 O75460 1/20 0.43

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
SCHEMBL4600386 0.89 PTPN11 (0.56) PTPN11CFDPTPN1PTPN6KMO
SCHEMBL2771810 0.87 CFD (0.61) PTPN11CFDTSHRHSD17B10PTPN1
SCHEMBL4602938 0.84 PTPN11 (0.56) PTPN11CFDTSHRHSD17B10PTPN1
SCHEMBL4602041 0.82 PTPN11 (0.57) PTPN11CFDTSHRHSD17B10PTPN1
SCHEMBL4603368 0.81 PTPN11 (0.59) PTPN11CFDTSHRHSD17B10PTPN1
SCHEMBL4602328 0.81 PTPN11 (0.56) PTPN11CFDTSHRHSD17B10PTPN1
SCHEMBL4601409 0.79 PTPN11 (0.57) PTPN11CFDTSHRHSD17B10PTPN1
SCHEMBL4602039 0.78 TSHR (0.52) PTPN11TSHRHSD17B10NPC1RAB9A
SCHEMBL4600417 0.78 PTPN11 (0.60) PTPN11CFDTSHRHSD17B10PTPN1
SCHEMBL4603254 0.78 TSHR (0.59) PTPN11CFDTSHRHSD17B10PTPN1

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 4 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
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US 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 3529/4885CFD 1224/4885TSHR 122/4885

“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.