SCHEMBL4641978

SCHEMBL4641978

CC1C=Cc2cc(I)cc(C(=O)O)c2O1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.33
PTPN2 P17706 1/20 0.33
PTPN1 P18031 1/20 0.33
PTPRA P18433 1/20 0.33
PTPRB P23467 1/20 0.33
PTPRE P23469 1/20 0.33
PTPN6 P29350 1/20 0.33
MAOB P27338 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL4641357 0.70 ALDH1A1 (0.41) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL4641334 0.69 CYP1A1 (0.33) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL25979871 0.60 AKR1C2 (0.46) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL28106879 0.60 PTPRC (0.42) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL8298037 0.60 PTGS2 (0.50)
SCHEMBL8463512 0.59 PTPRC (0.43) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL23880557 0.58 CYP3A4 (0.48) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL16122323 0.58 PTPRC (0.41) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL1462336 0.58 KDM4E (0.48) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL25765869 0.58 NOTUM (0.40) PTPRCPTPN2PTPN1PTPRAPTPRB

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
US-20080207728-A1 BICYCLIC ACYLTRYPTOPHANOLS BAYER SCHERING PHARMA AG (DE) 2008-08-28 US claimed
EP-1956016-A1 Bicyclic acyltryptophanols Bayer Schering Pharma Aktiengesellschaft (DE) 2008-08-13 EP claimed
WO-2008071455-A1 BICYCLIC ACYLTRYPTOPHANOLS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-19 WO claimed
US-20080207728-A1 BICYCLIC ACYLTRYPTOPHANOLS BAYER SCHERING PHARMA AG (DE) 2008-08-28 US disclosed
EP-1956016-A1 Bicyclic acyltryptophanols Bayer Schering Pharma Aktiengesellschaft (DE) 2008-08-13 EP disclosed
WO-2008071455-A1 BICYCLIC ACYLTRYPTOPHANOLS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-19 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-20080207728-A1 BICYCLIC ACYLTRYPTOPHANOLS FSHR, GNRHR, TPH1 PTPRC 4177/4885PTPN2 4232/4885PTPN1 4223/4885

“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.