SCHEMBL26525969

SCHEMBL26525969

COc1cccc(-n2ncc3c(OC)nc(CCl)nc32)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
POLB P06746 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
TSHR P16473 2/20 0.48
HTT P42858 1/20 0.48
LMNA P02545 1/20 0.47
CYP17A1 P05093 1/20 0.45
CYP1A2 P05177 1/20 0.45
USP7 Q93009 1/20 0.44
KDM4E B2RXH2 2/20 0.44
GAA P10253 1/20 0.44
RXFP1 Q9HBX9 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
XBP1 P17861 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 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
SCHEMBL30120729 0.87 SMN1; SMN2 (0.50) ALDH1A1MAPTHPGDPOLBSMN1; SMN2
SCHEMBL23723574 0.87 SMN1; SMN2 (0.50) ALDH1A1MAPTHPGDPOLBSMN1; SMN2
SCHEMBL23723775 0.73 SMN1; SMN2 (0.51) ALDH1A1MAPTHPGDPOLBSMN1; SMN2
SCHEMBL30596268 0.73 NPBWR1 (0.48) ALDH1A1MAPTHPGDSMN1; SMN2TSHR
SCHEMBL30120767 0.72 GRM1 (0.52) ALDH1A1MAPTHPGDSMN1; SMN2TSHR
SCHEMBL23723551 0.72 GRM1 (0.52) ALDH1A1MAPTHPGDSMN1; SMN2TSHR
SCHEMBL30596266 0.72 PDE4D (0.49) ALDH1A1MAPTHPGDPOLBSMN1; SMN2
SCHEMBL1353714 0.72 TSHR (0.53) ALDH1A1MAPTHPGDPOLBSMN1; SMN2
SCHEMBL1355429 0.71 SMN1; SMN2 (0.51) ALDH1A1MAPTHPGDPOLBSMN1; SMN2
SCHEMBL839950 0.70 SLC2A1 (0.60) ALDH1A1MAPTHPGDSMN1; SMN2HTT

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-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 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-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 IDUA, MAN2B1, GBA1 ALDH1A1 796/4885MAPT 2501/4885HPGD 3872/4885

“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.