SCHEMBL31652004

SCHEMBL31652004

COc1ccc(Br)nc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 4/20 0.51
SMPD3 Q9NY59 2/20 0.48
SUV39H2 Q9H5I1 4/20 0.47
GBA1 P04062 2/20 0.47
GPR119 Q8TDV5 1/20 0.46
TLR7 Q9NYK1 2/20 0.46
CKS1B P61024 1/20 0.45
SKP1 P63208 1/20 0.45
SKP2 Q13309 1/20 0.45
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
MAP4K4 O95819 1/20 0.43
CFTR P13569 1/20 0.43
BACE1 P56817 1/20 0.43
KIT P10721 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
SCHEMBL17310150 1.00 TLR9 (0.51) TLR9SMPD3SUV39H2GBA1GPR119
SCHEMBL15401487 0.88 PDE4B (0.42) TLR9SMPD3SUV39H2GBA1GPR119
SCHEMBL31651998 0.86 SMPD3 (0.53) TLR9SMPD3SUV39H2GBA1GPR119
SCHEMBL31651790 0.85 TLR9 (0.51) TLR9SMPD3SUV39H2GBA1GPR119
SCHEMBL24485823 0.84 GBA1 (0.47) TLR9GBA1GPR119CKS1BSKP1
SCHEMBL31651709 0.83 TLR9 (0.49) TLR9SMPD3SUV39H2GBA1GPR119
SCHEMBL17310111 0.82 GPR119 (0.45) TLR9GPR119ALDH1A1CFTR
SCHEMBL17310110 0.82 GPR119 (0.45) TLR9GPR119ALDH1A1CFTR
SCHEMBL20919447 0.81 BACE1 (0.46) TLR9SMPD3SUV39H2GPR119CKS1B
SCHEMBL31651803 0.81 TLR9 (0.47) TLR9SMPD3SUV39H2GBA1GPR119

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-20250214977-A1 STAT6 INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-07-03 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-20250214977-A1 STAT6 INHIBITORS AND USES THEREOF STAT6, STAT5B, STAT5A TLR9 301/4885SMPD3 2793/4885SUV39H2 181/4885

“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.