SCHEMBL1749795

SCHEMBL1749795

CCCCOc1ccc(C(=O)O)cc1F

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.62
THRB P10828 1/20 0.62
LMNA P02545 1/20 0.61
MAPK1 P28482 1/20 0.61
HTT P42858 1/20 0.61
RAB9A P51151 1/20 0.61
ALDH1A1 P00352 1/20 0.58
HPGD P15428 1/20 0.58
TP53 P04637 1/20 0.58
TSHR P16473 1/20 0.58
PTPN11 Q06124 1/20 0.57
PLA2G2D Q9UNK4 1/20 0.56
PLA2G4B P0C869 1/20 0.56
RARB P10826 3/20 0.54
PLA2G2A P14555 1/20 0.53

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
SCHEMBL9440011 0.97 THRA (0.66) THRATHRBLMNAMAPK1HTT
SCHEMBL15731804 0.95 THRA (0.68) THRATHRBLMNAMAPK1HTT
SCHEMBL8646009 0.95 THRA (0.68) THRATHRBLMNAMAPK1HTT
SCHEMBL5347089 0.95 THRA (0.68) THRATHRBLMNAMAPK1HTT
SCHEMBL9437150 0.95 THRA (0.68) THRATHRBLMNAMAPK1HTT
SCHEMBL9440284 0.95 THRA (0.68) THRATHRBLMNAMAPK1HTT
SCHEMBL5358465 0.95 THRA (0.68) THRATHRBLMNAMAPK1HTT
SCHEMBL9440043 0.95 THRA (0.68) THRATHRBLMNAMAPK1HTT
Hydrochloric Acid SCHEMBL9626607 0.94 THRA (0.67) THRATHRBLMNAMAPK1HTT
Hydrochloric Acid SCHEMBL7523098 0.94 THRA (0.67) THRATHRBLMNAMAPK1HTT

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-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 US disclosed
US-9458176-B2 Tetrahydroimidazo(1,5-D)[1,4]oxazepine derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-10-04 US disclosed
WO-2014133022-A1 TETRAHYDROIMIDAZO[1,5-D][1,4]OXAZEPINE DERIVATIVE エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2014-09-04 WO disclosed
US-20140243316-A1 Tetrahydroimidazo(1,5-D)[1,4]Oxazepine Derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2014-08-28 US disclosed
US-7968550-B2 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2011-06-28 US disclosed
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-09-06 US disclosed
US-7223788-B2 therapy for eating disorders, anorexigenic agents, antidiabetic agents, reducing weight in mammals, circadian rhythm disease, psychological disorders SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-05-29 US disclosed
CN-1859908-A 3,5-aryl, heteroaryl or cycloalkyl substituted-1,2,4-oxadiazoles as S1P receptor agonists MERCK & CO INC (US) 2006-11-08 CN disclosed
US-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-11-04 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 (4 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-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments CYP11B2, CYP11B1, CYP1A1 THRA 4014/4885THRB 4348/4885LMNA 2677/4885
US-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 THRA 4473/4885THRB 3843/4885LMNA 2339/4885
US-20140243316-A1 Tetrahydroimidazo(1,5-D)[1,4]Oxazepine Derivative GRM2, GRM1, GRIA2 THRA 1797/4885THRB 1969/4885LMNA 4725/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 THRA 3985/4885THRB 4200/4885LMNA 2573/4885

“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.