SCHEMBL2328705

SCHEMBL2328705

Cc1ccc(OCc2ccccc2)cc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.60
NR4A2 P43354 2/20 0.57
NR4A1 P22736 1/20 0.57
NR4A3 Q92570 1/20 0.57
MCL1 Q07820 2/20 0.56
MRGPRX4 Q96LA9 2/20 0.56
CTSV O60911 1/20 0.56
CTSL P07711 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
P4HTM Q9NXG6 1/20 0.55
SLC16A3 O15427 1/20 0.54
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
MDH2 P40926 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SRD5A2 P31213 2/20 0.53
LTB4R Q15722 1/20 0.52
LTB4R2 Q9NPC1 1/20 0.52
ALOX5 P09917 1/20 0.51

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
SCHEMBL12998985 0.88 MAOB (0.60) MAOBMRGPRX4SMN1; SMN2
SCHEMBL2327231 0.88 MAOB (0.57) MAOBNR4A2NR4A1NR4A3MCL1
SCHEMBL10976121 0.88 MAOB (0.57) MAOBNR4A2NR4A1NR4A3MRGPRX4
Benzene SCHEMBL28056879 0.88 MAOB (0.64) MAOBNR4A2NR4A1NR4A3MCL1
SCHEMBL1022035 0.88 MAOB (0.64) MAOBNR4A2NR4A1NR4A3MCL1
SCHEMBL2321431 0.87 KMT2A (0.56) MAOBNR4A2NR4A1NR4A3MRGPRX4
SCHEMBL12998989 0.87 MAOA (0.60) MAOBNR4A2MRGPRX4KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL9440598 0.86 MAOB (0.62) MAOBNR4A2NR4A1NR4A3MCL1
SCHEMBL1557204 0.86 RXRA (0.65) MAOBNR4A2MRGPRX4MEN1KMT2A
SCHEMBL12998987 0.86 NR4A2 (0.65) MAOBNR4A2MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104387265-B A kind of preparation method of 4,5-dihydroxy-2-ar-Toluic acid 盐城师范学院 2016-10-26 CN claimed
US-9340522-B2 Pyrazolone-derivatives and their use as PDE-4 inhibitors TAKEDA GMBH (DE) 2016-05-17 US disclosed
US-9181186-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-10 US disclosed
EP-2356103-B1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS TAKEDA GMBH (DE) 2015-08-26 EP disclosed
US-20150045378-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-12 US disclosed
EP-2816032-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-12-24 EP disclosed
US-20140073672-A1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PDE-4 INHIBITORS TAKEDA GMBH (DE) 2014-03-13 US disclosed
US-8609848-B2 Pyrazolone-derivatives and their use as PDE-4 inhibitors TAKEDA GMBH (DE) 2013-12-17 US disclosed
US-20130261185-A1 Benzamide Derivatives As EP4 Receptor Agonists GLAXO GROUP LIMITED (GB) 2013-10-03 US disclosed
US-20130261185-A1 Benzamide Derivatives As EP4 Receptor Agonists GLAXO GROUP LIMITED (GB) 2013-10-03 US disclosed
US-20110218201-A1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PDE-4 INHIBITORS NYCOMED GMBH (DE) 2011-09-08 US disclosed
EP-2356103-A1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PD4 INHIBITORS Nycomed GmbH (DE) 2011-08-17 EP disclosed
US-20100305166-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED 2010-12-02 US disclosed
US-20100305166-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED 2010-12-02 US disclosed
WO-2010055083-A1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PD4 INHIBITORS NYCOMED GMBH (DE) 2010-05-20 WO disclosed
US-20100022650-A1 Benzamide Derivatives As EP4 Receptor Agonists GLAXO GROUP LIMITED (GB) 2010-01-28 US disclosed
US-20100022650-A1 Benzamide Derivatives As EP4 Receptor Agonists GLAXO GROUP LIMITED (GB) 2010-01-28 US disclosed
WO-2009056582-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-05-07 WO disclosed
US-20080167377-A1 Novel compounds GLAXO GROUP LIMITED (GB) 2008-07-10 US disclosed
WO-2008071736-A1 BENZAMIDE DERIVATIVES AS EP4 RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 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 (7 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-20080167377-A1 Novel compounds F12, C1R, MRGPRX1 MAOB 1261/4885NR4A2 1158/4885NR4A1 248/4885
US-20100305166-A1 NOVEL COMPOUNDS F12, C1R, RPS4X MAOB 2551/4885NR4A2 557/4885NR4A1 145/4885
US-20100022650-A1 Benzamide Derivatives As EP4 Receptor Agonists PTGER4, PTGER1, PTGER3 MAOB 1430/4885NR4A2 126/4885NR4A1 54/4885
US-20150045378-A1 AROMATIC RING COMPOUND GPR119, GPR27, GPR4 MAOB 3876/4885NR4A2 28/4885NR4A1 29/4885
US-20130261185-A1 Benzamide Derivatives As EP4 Receptor Agonists PTGER4, PTGER1, PTGER3 MAOB 1430/4885NR4A2 126/4885NR4A1 54/4885
US-20110218201-A1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PDE-4 INHIBITORS PDE4A, PDE3B, PDE3A MAOB 224/4885NR4A2 1052/4885NR4A1 1469/4885
US-20140073672-A1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PDE-4 INHIBITORS PDE4A, PDE3B, PDE3A MAOB 224/4885NR4A2 1052/4885NR4A1 1469/4885

“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.