SCHEMBL3077835

SCHEMBL3077835

CCCCOc1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.80
TP53 P04637 1/20 0.64
TSHR P16473 1/20 0.64
PLA2G4B P0C869 8/20 0.62
RARB P10826 4/20 0.58
KMT2A Q03164 1/20 0.57
PLA2G4A P47712 1/20 0.55
NR1H4 Q96RI1 1/20 0.54

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
SCHEMBL28627609 0.98 PLA2G2A (0.77) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL10830829 0.96 PLA2G2A (0.86) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL8733941 0.94 PLA2G2A (0.90) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL1820396 0.93 PLA2G2A (0.93) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL15955753 0.93 PLA2G2A (0.93) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL1768821 0.93 PLA2G2A (0.93) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL1768906 0.93 PLA2G2A (0.93) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL28635177 0.91 PLA2G2A (0.90) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL28630926 0.91 PLA2G2A (0.90) PLA2G2ATP53TSHRPLA2G4BRARB
Hydrochloric Acid SCHEMBL4592930 0.91 PLA2G2A (0.90) PLA2G2ATP53TSHRPLA2G4BRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7789943-B2 Metal, ligand molecular sieves; temperature adjustable pores; controlling particle size MIAMI UNIVERSITY (US) 2010-09-07 US claimed
US-20080184881-A1 MESH-ADJUSTABLE MOLECULAR SIEVE MIAMI UNIVERSITY (US) 2008-08-07 US claimed
US-20230150951-A1 2,5- OR 2,6-DISUBSTITUTED HYDROQUINONE DERIVATIVES WITH AT LEAST ONE CARBOXY, SULFO OR AMIDO GROUP USEFUL AS MEDICAMENTS OM PHARMA SA (CH) 2023-05-18 US disclosed
US-10440955-B2 Methods comprising a biocidal polyamine CURZA GLOBAL, LLC (US) 2019-10-15 US disclosed
US-20180125070-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE THE UNIVERSITY OF UTAH 2018-05-10 US disclosed
US-9839219-B2 Compositions comprising a biocidal polyamine CURZA GLOBAL, LLC (US) 2017-12-12 US disclosed
US-20160330962-A1 COMPOSITIONS COMPRISING A BIOCIDAL POLYAMINE CURZA GLOBAL, LLC 2016-11-17 US disclosed
US-9439433-B2 Compositions and methods comprising a biocidal polyamine CURZA GLOBAL, LLC (US) 2016-09-13 US disclosed
EP-2999345-A1 COMPOSITIONS AND METHODS COMPRISING A POLYAMINE Curza Global LLC (US) 2016-03-30 EP disclosed
US-20150038512-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE THE UNIVERSITY OF UTAH 2015-02-05 US disclosed
WO-2014190096-A1 COMPOSITIONS AND METHODS COMPRISING A POLYAMINE CURZA GLOBAL, LLC (US) 2014-11-27 WO disclosed
US-8362237-B2 Optical-isomer separating agent for chromatography and process for producing the same NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) 2013-01-29 US disclosed
US-8337591-B2 Mesh-adjustable molecular sieve MIAMI UNIVERSITY (US) 2012-12-25 US disclosed
US-20100292464-A1 OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-11-18 US disclosed
US-7789943-B2 Metal, ligand molecular sieves; temperature adjustable pores; controlling particle size MIAMI UNIVERSITY (US) 2010-09-07 US disclosed
US-20100170393-A1 MESH-ADJUSTABLE MOLECULAR SIEVE MIAMI UNIVERSITY (US) 2010-07-08 US disclosed
US-20080184881-A1 MESH-ADJUSTABLE MOLECULAR SIEVE MIAMI UNIVERSITY (US) 2008-08-07 US disclosed
US-7344704-B2 Use of perfluoroalkyl-containing metal complexes as contrast media in MR-imaging for visualization of intravascular thrombi SCHERING AG (DE) 2008-03-18 US disclosed
US-20070269384-A1 Use of perfluoroalkyl-containing metal complexes as contrast media for diagnosis of Alzheimer's disease BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-11-22 US disclosed
US-20070269384-A1 Use of perfluoroalkyl-containing metal complexes as contrast media for diagnosis of Alzheimer's disease BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-11-22 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 (8 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-20230150951-A1 2,5- OR 2,6-DISUBSTITUTED HYDROQUINONE DERIVATIVES WITH AT LEAST ONE CARBOXY, SULFO OR AMIDO GROUP USEFUL AS MEDICAMENTS HRH4, NCOA4, HRH3 PLA2G2A 2298/4885TP53 1847/4885TSHR 1884/4885
US-20080184881-A1 MESH-ADJUSTABLE MOLECULAR SIEVE TRPA1, TRPM4, TRPV4 PLA2G2A 2737/4885TP53 593/4885TSHR 2696/4885
US-20160330962-A1 COMPOSITIONS COMPRISING A BIOCIDAL POLYAMINE SRM, SMS, SMOX PLA2G2A 1304/4885TP53 2933/4885TSHR 4339/4885
US-20070269384-A1 Use of perfluoroalkyl-containing metal complexes as contrast media for diagnosis of Alzheimer's disease APP, APBA1, PSEN1 PLA2G2A 643/4885TP53 300/4885TSHR 1511/4885
US-10440955-B2 Methods comprising a biocidal polyamine SRM, SMOX, SMS PLA2G2A 1300/4885TP53 3345/4885TSHR 4247/4885
US-20180125070-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE SRM, SMOX, SMS PLA2G2A 1121/4885TP53 2932/4885TSHR 4388/4885
US-20100292464-A1 OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME ORC3, OXER1, HCCS PLA2G2A 2029/4885TP53 4325/4885TSHR 2815/4885
US-20150038512-A1 COMPOSITIONS AND METHODS COMPRISING A BIOCIDAL POLYAMINE SRM, SMOX, SMS PLA2G2A 1121/4885TP53 2932/4885TSHR 4388/4885

“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.