SCHEMBL7110836

SCHEMBL7110836

CS(=O)(=O)Nc1cc(OCc2ccccc2)cc(C(O)CNCCOc2ccc3c(c2)[nH]c2ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 17/20 0.53
ADRA1A P35348 11/20 0.53
CTSV O60911 1/20 0.47
CTSL P07711 1/20 0.47
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
NPC1 O15118 1/20 0.43
AR P10275 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL6915474 0.89 ADRB3 (0.57) ADRB3ADRA1A
Hydrochloric Acid SCHEMBL7107166 0.88 ADRB3 (0.56) ADRB3ADRA1A
SCHEMBL6911186 0.86 ADRB3 (0.51) ADRB3ADRA1ACTSVCTSL
Hydrochloric Acid SCHEMBL7106190 0.86 ADRB3 (0.50) ADRB3ADRA1ACTSVCTSL
SCHEMBL6740387 0.86 ADRB3 (0.70) ADRB3ADRA1ADRD2DRD4DRD3
SCHEMBL6914674 0.86 ADRB3 (0.70) ADRB3ADRA1ADRD2DRD4DRD3
SCHEMBL6911204 0.86 ADRB3 (0.70) ADRB3ADRA1ADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7638625 0.85 ADRB3 (0.67) ADRB3ADRA1ADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7110498 0.85 ADRB3 (0.69) ADRB3ADRA1ADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7110843 0.85 ADRB3 (0.69) ADRB3ADRA1ADRD2DRD4DRD3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882707-B1 NOVEL TRICYCLIC COMPOUNDS AND DRUG COMPOSITIONS CONTAINING THE SAME ASAHI CHEMICAL IND (JP) 2003-10-08 EP disclosed
US-20030139475-A1 Novel tricyclic compounds and drug compositions containing same ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2003-07-24 US disclosed
US-6545053-B1 Aminoethoxyfluorene derivatives are beta-3 adrenaline receptor agonists and are useful as drugs for the treatment and prevention of diabetes, obesity, hyperlipemia, etc. ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2003-04-08 US disclosed
US-6187809-B1 BETA-3 ADRENALINE RECEPTOR AGONIST DRUGS FOR THE TREATMENT OF DIABETES, OBESITY, AND HYPERLIPEMIA; 2-(N-(2-(DIBENZOFURAN-3-YLOXY)ETHYL)AMINO)-1-PHENYLETHANOL, FOR EXAMPLE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-02-13 US disclosed
US-6037362-A CARBAZOLE DERIVATIVES; DEPROTECTING, AMINATION; ANTILIPEMIC AND ANTIDIABETIC AGENTS; B-ADRENALINE RECEPTOR AGONISTS; DIETETICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2000-03-14 US disclosed
EP-0882707-A1 NOVEL TRICYCLIC COMPOUNDS AND DRUG COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1998-12-09 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 (1 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-20030139475-A1 Novel tricyclic compounds and drug compositions containing same ADRB3, MC2R, NR3C1 ADRB3 1/4885ADRA1A 21/4885CTSV 4729/4885

“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.