SCHEMBL765937

SCHEMBL765937

CCc1cccc(OCC(=O)O)c1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.68
PPARG P37231 1/20 0.68
LMNA P02545 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.58
ALOX15 P16050 1/20 0.58
POLB P06746 2/20 0.58
MAPK1 P28482 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
TSHR P16473 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
PLA2G4B P0C869 2/20 0.54
PTPN7 P35236 1/20 0.53
FFAR1 O14842 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL9122812 0.86 LMNA (0.55) PPARAPPARGLMNASMN1; SMN2POLB
SCHEMBL11214096 0.85 SMN1; SMN2 (0.54) PPARAPPARGLMNASMN1; SMN2POLB
SCHEMBL1816186 0.85 MAPK1 (0.54) PPARAPPARGLMNASMN1; SMN2POLB
SCHEMBL7049768 0.84 LMNA (0.62) PPARAPPARGLMNAALOX15MAPK1
SCHEMBL4465276 0.84 LMNA (0.62) PPARAPPARGLMNASMN1; SMN2ALOX15
SCHEMBL10174538 0.83 SMN1; SMN2 (0.56) PPARAPPARGLMNASMN1; SMN2POLB
SCHEMBL22396867 0.83 LMNA (0.66) PPARAPPARGLMNAALOX15MAPK1
SCHEMBL8986815 0.83 LMNA (0.61) PPARAPPARGLMNAALOX15MAPK1
SCHEMBL413254 0.83 LMNA (0.81) PPARAPPARGLMNAALOX15MAPK1
SCHEMBL2936246 0.83 PPARA (0.60) PPARAPPARGLMNAALOX15MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3297438-B1 CCR2 MODULATORS CHEMOCENTRYX INC (US) 2021-10-20 EP disclosed
US-10556904-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2020-02-11 US disclosed
US-20190194191-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2019-06-27 US disclosed
US-20180072667-A1 SELECTIVE FKBP51 LIGANDS FOR TREATMENT OF PSYCHIATRIC DISORDERS HAUSCH, FELIX (DE) 2018-03-15 US disclosed
US-9604981-B2 IP receptor agonist heterocyclic compounds NOVARTIS AG (CH) 2017-03-28 US disclosed
US-9550779-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2017-01-24 US disclosed
US-9493436-B2 Tyrosine phosphatase inhibitors and uses thereof to modulate the activity of enzymes involved in the pathology of Mycobacterium tuberculosis INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2016-11-15 US disclosed
US-20160289184-A1 SELECTIVE FKBP51 LIGANDS FOR TREATMENT OF PSYCHIATRIC DISORDERS HAUSCH, FELIX (DE) 2016-10-06 US disclosed
US-9102599-B2 N-((3-benzyl)-2,2-(bis-phenyl)-propan-1-amine derivatives as CETP inhibitors for the treatment of atherosclerosis and cardiovascular diseases BRISTOL-MYERS SQUIBB COMPANY (US) 2015-08-11 US disclosed
US-20130184279-A1 N-((3-BENZYL)-2,2-(BIS-PHENYL)-PROPAN-1-AMINE DERIVATIVES AS CETP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROSIS AND CARDIOVASCULAR DISEASES BRISTOL-MYERS SQUIBB COMPANY (US) 2013-07-18 US disclosed
US-7790770-B2 Heterocyclic CETP inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-09-07 US disclosed
US-7674786-B2 Therapeutic β-lactams ALLERGAN, INC. (US) 2010-03-09 US disclosed
US-20100041717-A1 N-((3-BENZYL)-2,2-(BIS-PHENYL)-PROPAN-1-AMINE DERIVATIVES AS CETP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROSIS AND CARDIOVASCULAR DISEASES BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-18 US disclosed
US-20090286974-A1 Derivative having ppar agonistic activity SHIONOGI & CO., LTD. (JP) 2009-11-19 US disclosed
US-20090137614-A1 Pharmaceutical combination comprising vitamin k SHIONOGI & CO., LTD. (JP) 2009-05-28 US disclosed
US-20080113943-A1 Therapeutic Beta-Lactams ALLERGAN, INC. (US) 2008-05-15 US disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-14 US disclosed
WO-2007062314-A2 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-31 WO disclosed
WO-2007062308-A2 HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-31 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 (11 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-20070161685-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 PPARA 827/4885PPARG 890/4885LMNA 170/4885
US-20090137614-A1 Pharmaceutical combination comprising vitamin k PPARD, PROC, VDR PPARA 4/4885PPARG 5/4885LMNA 208/4885
US-20100041717-A1 N-((3-BENZYL)-2,2-(BIS-PHENYL)-PROPAN-1-AMINE DERIVATIVES AS CETP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROSIS AND CARDIOVASCULAR DISEASES CETP, APOB, CES1 PPARA 572/4885PPARG 1127/4885LMNA 106/4885
US-20180072667-A1 SELECTIVE FKBP51 LIGANDS FOR TREATMENT OF PSYCHIATRIC DISORDERS FKBP5, FKBP1A, FKBP3 PPARA 1239/4885PPARG 979/4885LMNA 4560/4885
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 PPARA 827/4885PPARG 890/4885LMNA 170/4885
US-10556904-B2 Derivatives and methods of treating hepatitis B infections HAVCR2, PYGL, HCCS PPARA 370/4885PPARG 627/4885LMNA 1546/4885
US-20080113943-A1 Therapeutic Beta-Lactams NRDC, DDO, DAO PPARA 2330/4885PPARG 3144/4885LMNA 490/4885
US-20090286974-A1 Derivative having ppar agonistic activity PPARD, PPARA, PPARG PPARA 2/4885PPARG 3/4885LMNA 2761/4885
US-20160289184-A1 SELECTIVE FKBP51 LIGANDS FOR TREATMENT OF PSYCHIATRIC DISORDERS FKBP5, FKBP1A, FKBP1B PPARA 1685/4885PPARG 999/4885LMNA 4500/4885
US-20190194191-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS PPARA 370/4885PPARG 627/4885LMNA 1546/4885
US-20130184279-A1 N-((3-BENZYL)-2,2-(BIS-PHENYL)-PROPAN-1-AMINE DERIVATIVES AS CETP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROSIS AND CARDIOVASCULAR DISEASES CETP, APOB, CES1 PPARA 588/4885PPARG 1040/4885LMNA 105/4885

“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.