SCHEMBL29601468

SCHEMBL29601468

Oc1ccc(Nc2nc(-c3ccccn3)cs2)nc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 4/20 0.73
MBD2 Q9UBB5 2/20 0.72
KCNN1 Q92952 2/20 0.72
KCNN2 Q9H2S1 2/20 0.72
KCNN3 Q9UGI6 2/20 0.72
MECP2 P51608 1/20 0.72
NR4A1 P22736 1/20 0.70
VCP P55072 1/20 0.70
NPC1 O15118 9/20 0.64
KMT2A Q03164 7/20 0.64
RAB9A P51151 7/20 0.64
MEN1 O00255 6/20 0.64
MAPT P10636 5/20 0.60
SMN1; SMN2 Q16637 5/20 0.60
NFKB1 P19838 4/20 0.60
NFKB2 Q00653 4/20 0.60
RELA Q04206 4/20 0.60
PPP1CA P62136 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
NR1I2 O75469 1/20 0.60

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
SCHEMBL24358150 1.00 SLC2A1 (0.73) SLC2A1MBD2KCNN1KCNN2KCNN3
Hydrochloric Acid SCHEMBL27039824 0.99 SLC2A1 (0.71) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL30745771 0.84 KCNN1 (1.00) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL5155715 0.84 KCNN1 (1.00) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL6372841 0.84 SLC2A1 (0.73) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL5155606 0.84 SLC2A1 (1.00) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL6368664 0.84 SLC2A1 (0.73) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL14742535 0.84 SLC2A1 (1.00) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL6369179 0.83 SLC2A1 (0.71) SLC2A1MBD2KCNN1KCNN2KCNN3
SCHEMBL30745767 0.83 SLC2A1 (0.71) SLC2A1MBD2KCNN1KCNN2KCNN3

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-20240025891-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CELGENE CORPORATION 2024-01-25 US disclosed
EP-4232449-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES Celgene Corporation (US) 2023-08-30 EP disclosed
CN-116547282-A Heterocyclic compounds and their use for the treatment of helminth infections and diseases 新基公司 2023-08-04 CN disclosed
WO-2022087326-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CELGENE CORPORATION (US) 2022-04-28 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-20240025891-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CYP8B1, PAH, INHA SLC2A1 3987/4885MBD2 4859/4885KCNN1 4605/4885

“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.