SCHEMBL7253628

SCHEMBL7253628

Cc1ccc2c(c1)[nH]c1cc(OCCNCC(O)c3cccc(NS(C)(=O)=O)c3)ccc12

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.70
ADRA1A P35348 11/20 0.70
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45

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
SCHEMBL7255111 1.00 ADRB3 (0.70) ADRB3ADRA1ADRD2DRD4DRD3
SCHEMBL7257111 1.00 ADRB3 (0.70) ADRB3ADRA1ADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7251408 0.99 ADRB3 (0.69) ADRB3ADRA1ADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7251411 0.99 ADRB3 (0.69) ADRB3ADRA1ADRD2DRD4DRD3
SCHEMBL7251839 0.94 ADRB3 (0.72) ADRB3ADRA1ADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7252861 0.93 ADRB3 (0.71) ADRB3ADRA1AADRB2ADRB1
Hydrochloric Acid SCHEMBL7252857 0.93 ADRB3 (0.71) ADRB3ADRA1AADRB2ADRB1
SCHEMBL6911204 0.92 ADRB3 (0.70) ADRB3ADRA1ADRD2DRD4DRD3
SCHEMBL7250660 0.92 ADRB3 (0.75) ADRB3ADRA1ADRD2DRD4DRD3
SCHEMBL7251200 0.92 ADRB3 (0.77) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030040538-A1 Novel substituted tricyclic compounds ASAHI-KASEI KABUSHIKI KAISHA (JP) 2003-02-27 US disclosed
EP-1238973-A1 NOVEL SUBSTITUTED TRICYCLIC COMPOUNDS Asahi Kasei Kabushiki Kaisha (JP) 2002-09-11 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-20030040538-A1 Novel substituted tricyclic compounds CPT1A, CBR1, NR1H3 ADRB3 442/4885ADRA1A 810/4885DRD2 1040/4885

“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.