SCHEMBL23723600

SCHEMBL23723600

COc1ccccc1-n1ncc2c(O)nc(CCl)nc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 7/20 0.45
SLC2A3 P11169 7/20 0.45
SLC2A2 P11168 6/20 0.45
CYP17A1 P05093 1/20 0.43
CYP1A2 P05177 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK14 Q16539 1/20 0.40
GSK3B P49841 2/20 0.39
MAPT P10636 4/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PDE9A O76083 1/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38

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
SCHEMBL30120627 1.00 SLC2A1 (0.45) SLC2A1SLC2A3SLC2A2CYP17A1CYP1A2
SCHEMBL23723532 0.84 GRM5 (0.49) SLC2A1SLC2A3SLC2A2CYP1A2NPC1
SCHEMBL23723660 0.78 KMT2A (0.47) CYP1A2NPC1RAB9AMAPTALDH1A1
SCHEMBL23723775 0.78 SMN1; SMN2 (0.51) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL30120729 0.78 SMN1; SMN2 (0.50) SLC2A1SLC2A3SLC2A2CYP17A1CYP1A2
SCHEMBL23723574 0.78 SMN1; SMN2 (0.50) SLC2A1SLC2A3SLC2A2CYP17A1CYP1A2
SCHEMBL6205196 0.76 SLC2A1 (0.65) SLC2A1SLC2A3SLC2A2CYP17A1CYP1A2
SCHEMBL30132099 0.76 PDE9A (0.38) SLC2A1SLC2A3SLC2A2CYP17A1CYP1A2
SCHEMBL23723650 0.76 PDE9A (0.38) SLC2A1SLC2A3SLC2A2CYP17A1CYP1A2
SCHEMBL23723527 0.74 SMN1; SMN2 (0.51) CYP1A2NPC1RAB9AL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
EP-4100015-A1 COMBINATION THERAPY FOR TREATING MPS1 Gain Therapeutics SA (CH) 2022-12-14 EP disclosed
WO-2021156774-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2021-08-12 WO disclosed
WO-2021156774-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2021-08-12 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-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 IDUA, MAN2B1, GBA1 SLC2A1 946/4885SLC2A3 1007/4885SLC2A2 1674/4885

“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.