SCHEMBL1232452

SCHEMBL1232452

C/C(C(=O)O)=C(/C)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.54
CES2 O00748 4/20 0.54
TSHR P16473 3/20 0.50
ALDH1A1 P00352 2/20 0.50
DAO P14920 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
CYP19A1 P11511 2/20 0.48
ESR1 P03372 1/20 0.46
MAPT P10636 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CYP3A4 P08684 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
CA2 P00918 2/20 0.46
CA4 P22748 2/20 0.46
POLB P06746 1/20 0.46
PARP1 P09874 1/20 0.46
CYP2C19 P33261 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46

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
SCHEMBL367453 1.00 CES1 (0.54) CES1CES2TSHRALDH1A1DAO
SCHEMBL367456 1.00 CES1 (0.54) CES1CES2TSHRALDH1A1DAO
SCHEMBL11671741 0.84 CES1 (0.61) CES1CES2TSHRALDH1A1DAO
SCHEMBL11671738 0.84 CES1 (0.61) CES1CES2TSHRALDH1A1DAO
SCHEMBL5072437 0.82 CES1 (0.52) CES1CES2TSHRALDH1A1DAO
SCHEMBL6067697 0.82 CES1 (0.52) CES1CES2TSHRALDH1A1DAO
SCHEMBL1562541 0.82 CES1 (0.52) CES1CES2TSHRALDH1A1DAO
SCHEMBL1562534 0.82 CES1 (0.52) CES1CES2TSHRALDH1A1DAO
SCHEMBL10589355 0.82 CES1 (0.52) CES1CES2TSHRALDH1A1DAO
SCHEMBL585335 0.82 CES1 (0.52) CES1CES2TSHRALDH1A1DAO

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1671698-A2 Device for holding a substance library carrier Clondiag Chip Technologies GmbH (DE) 2006-06-21 EP claimed
EP-1436086-B1 DEVICE FOR HOLDING A SUBSTANCE LIBRARY CARRIER CLONDIAG CHIP TECH GMBH (DE) 2006-03-29 EP claimed
EP-1633474-A1 DEVICE FOR HOLDING AND DETECTING SUBSTANCE LIBRARIES Clondiag Chip Technologies GmbH (DE) 2006-03-15 EP claimed
US-20050047973-A1 Device for holding a substance library carrier CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2005-03-03 US claimed
WO-2004103547-A1 DEVICE FOR HOLDING AND DETECTING SUBSTANCE LIBRARIES CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2004-12-02 WO claimed
EP-1436086-A2 DEVICE FOR HOLDING A SUBSTANCE LIBRARY CARRIER Clondiag Chip Technologies GmbH (DE) 2004-07-14 EP claimed
WO-2003031063-A2 DEVICE FOR HOLDING A SUBSTANCE LIBRARY CARRIER CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2003-04-17 WO claimed
US-20170058334-A1 REACTION VESSEL FOR CARRYING OUT ARRAY PROCESSES CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2017-03-02 US disclosed
EP-2305383-B1 DEVICES FOR CARRYING OUT AND DIAGNOSING MICROARRAY EXPERIMENTS CLONDIAG GMBH (DE) 2016-04-27 EP disclosed
US-9310291-B2 Reaction vessel for carrying out array processes CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2016-04-12 US disclosed
EP-2210665-B1 Apparatus for detecting target molecules CLONDIAG GMBH (DE) 2014-07-09 EP disclosed
US-20110105572-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS TOPOTARGET UK LIMITED (GB) 2011-05-05 US disclosed
EP-2305383-A1 Devices for carrying out and diagnosing microarray experiments CLONDIAG GmbH (DE) 2011-04-06 EP disclosed
US-20040092598-A1 Carbamic acid compounds comprising an amide linkage as hdac inhibitors TOPOTARGET UK LIMITED (GB) 2004-05-13 US disclosed
EP-1335898-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS Prolifix Limited (GB) 2003-08-20 EP disclosed
WO-2003059516-A1 REACTION VESSEL FOR CARRYING OUT ARRAY PROCESSES CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2003-07-24 WO disclosed
WO-2003031063-A2 DEVICE FOR HOLDING A SUBSTANCE LIBRARY CARRIER CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2003-04-17 WO disclosed
WO-2002026696-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS PROLIFIX LIMITED (GB) 2002-04-04 WO disclosed
EP-0572900-A2 Coating and its use in a process for preparing multilayer coatings Herberts Gesellschaft mit beschränkter Haftung (DE) 1993-12-08 EP disclosed
EP-0510762-A2 Liquid cleaning products UNILEVER N.V. (NL) 1992-10-28 EP 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-20040092598-A1 Carbamic acid compounds comprising an amide linkage as hdac inhibitors HDAC1, HDAC11, HDAC3 CES1 157/4885CES2 875/4885TSHR 2954/4885
US-20110105572-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS HDAC1, HDAC7, HDAC5 CES1 228/4885CES2 1249/4885TSHR 2210/4885

“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.