SCHEMBL7103274

SCHEMBL7103274

CC(C)(C)OC(=O)n1cnc(C2CCCc3c(NS(C)(=O)=O)cccc32)c1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 2/20 0.51
ADRA2A P08913 4/20 0.49
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37

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
SCHEMBL7102018 0.91 ADRA2A (0.51) ADRA1AADRA2A
SCHEMBL7098536 0.91 ADRA2A (0.51) ADRA1AADRA2A
SCHEMBL7097246 0.88 ADRA2A (0.53) ADRA1AADRA2A
SCHEMBL7169596 0.85 ALDH1A1 (0.42) ADRA1AADRA2A
SCHEMBL7102066 0.83 STS (0.36) ADRA1AADRA2A
SCHEMBL7102876 0.83 ADRA2A (0.41) ADRA2ADDB1CRBN
SCHEMBL7097659 0.83 ADRA2A (0.39) ADRA1AADRA2ADDB1CRBN
SCHEMBL7102100 0.81 ADRA1A (0.60) ADRA1AADRA2A
SCHEMBL7098219 0.81 DDB1 (0.39) ADRA2ADDB1CRBN
Hydrochloric Acid SCHEMBL7098366 0.80 ADRA1A (0.59) ADRA1AADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ABBOTT LABORATORIES 2003-04-17 US disclosed
US-6503935-B1 Treating urinary incontinence or retrograde ejaculation ABBOTT LABORATORIES 2003-01-07 US disclosed
EP-1259491-A1 4-IMIDAZOLE DERIVATIVES OF BENZYL AND RESTRICTED BENZYL SULFONAMIDES, SULFAMIDES, UREAS, CARBAMATES AND AMIDES AND THEIR USE AS ALPHA-1A AGONISTS Abbott Laboratories (US) 2002-11-27 EP disclosed
WO-2001060802-A1 4-IMIDAZOLE DERIVATIVES OF BENZYL AND RESTRICTED BENZYL SULFONAMIDES, SULFAMIDES, UREAS, CARBAMATES, AND AMIDES AND THEIR USE AS ALPHA-1A AGONISTS ABBOTT LABORATORIES (US) 2001-08-23 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 (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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ADRA1D, ADRB1, ADRA1A ADRA1A 3/4885ADRA2A 8/4885DDB1 2520/4885

“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.