SCHEMBL5574863

SCHEMBL5574863

CNC(=O)C=CC(O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
PARP1 P09874 2/20 0.30
PARP10 Q53GL7 2/20 0.30
PARP14 Q460N5 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
SCHEMBL12463129 0.79 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4PARP1
SCHEMBL179525 0.79 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4PARP1
SCHEMBL17120406 0.77 CHRNB2 (0.35) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL2486077 0.76 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA4PARP1
SCHEMBL1630761 0.76 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA4PARP1
SCHEMBL1630764 0.76 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA4PARP1
SCHEMBL18042843 0.75 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL18042846 0.75 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL25458780 0.72
SCHEMBL20160346 0.72

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275046-A1 Noval Surfactants and Applications Thereof TS PHARMA (FR) 2007-11-29 US disclosed
US-6359006-B2 ANTIISCHEMIC AGENTS; ANTICANCER AGENTS ALLIANCE PHARMACEUTICAL CORP. 2002-03-19 US disclosed
US-20020019442-A1 AMPHIPHILIC FLUORINE DERIVATIVES WITH TELOMERIC STRUCTURES; PREPARATION PROCEDURE AND BIOMEDICAL APPLICATIONS PFC THERAPEUTICS, LLC 2002-02-14 US disclosed
US-5847206-A Amphiphilic fluorine derivatives with telomeric structures; preparation procedure and biomedical applications ALLIANCE PHARMACEUTICAL CORP. (US) 1998-12-08 US disclosed
US-5703126-A USED AS MARKER, CARRIERS IN TRANSPORT OF GASES, CONTRAST AGENT, DRUG OR CARRIER FOR DRUG ALLIANCE PHARMACEUTICAL CORP. (US) 1997-12-30 US disclosed
US-5527962-A FLUOROPOLYMER WITH PERFLUOROALKYL MERCAPTAN END GROUP AS CARRIER FOR DRUG DELIVERY ALLIANCE PHARMACEUTICAL CORP. (US) 1996-06-18 US disclosed
EP-0548096-B1 AMPHIPHILIC FLUORINE DERIVATIVES WITH TELOMERIC STRUCTURES; PREPARATION AND BIOMEDICAL APPLICATIONS ATTA (FR) 1995-11-08 EP disclosed
EP-0548096-A1 AMPHIPHILIC FLUORINE DERIVATIVES WITH TELOMERIC STRUCTURES; PREPARATION AND BIOMEDICAL APPLICATIONS. ATTA (FR) 1993-06-30 EP disclosed
WO-1992002560-A1 AMPHIPHILIC FLUORINE DERIVATIVES WITH TELOMERIC STRUCTURES; PREPARATION AND BIOMEDICAL APPLICATIONS S.A. A.T.T.A. APPLICATIONS ET TRANSFERTS DE TECHNO (FR) 1992-02-20 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 (2 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-20070275046-A1 Noval Surfactants and Applications Thereof SGMS1, SGMS2, ANXA6 CHRNB2 2646/4885CHRNB4 3140/4885CHRNA3 3019/4885
US-20020019442-A1 AMPHIPHILIC FLUORINE DERIVATIVES WITH TELOMERIC STRUCTURES; PREPARATION PROCEDURE AND BIOMEDICAL APPLICATIONS POT1, TERF2, TELO2 CHRNB2 687/4885CHRNB4 1424/4885CHRNA3 1357/4885

“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.