SCHEMBL7103450

SCHEMBL7103450

CCS(=O)(=O)Nc1cc(Br)cc(Cc2c[nH]cn2)c1C

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.31
PDE10A Q9Y233 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL7097637 0.88 BRD4 (0.32) BRD4PDE10AHTT
SCHEMBL7248476 0.86 BRAF (0.34) PDE10AHTT
SCHEMBL7248382 0.81 NR3C1 (0.41) PDE10AHTT
SCHEMBL7248995 0.79 BRD4 (0.40) BRD4PDE10AHTT
SCHEMBL7101637 0.77 NR3C1 (0.39) PDE10A
SCHEMBL7248504 0.76 PSIP1 (0.37) BRD4
SCHEMBL7248295 0.76 PGR (0.37) BRD4HTT
SCHEMBL7102049 0.76 ADRA2A (0.39) BRD4HTT
SCHEMBL7103402 0.75 MRGPRX1 (0.34) PDE10AHTT
SCHEMBL7247802 0.74 SLC40A1 (0.33) PDE10AHTT

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 1 patent. 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

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 BRD4 26/4885PDE10A 250/4885HTT 4621/4885

“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.