SCHEMBL20597948

SCHEMBL20597948

C[Si](C)(C)CCOCn1c(Cl)cc2cc(C(=O)O)cnc21

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.38
F11 P03951 2/20 0.34
DGAT1 O75907 2/20 0.33
MGAM O43451 1/20 0.33
KLKB1 P03952 1/20 0.31
PIN1 Q13526 1/20 0.31
NR1H4 Q96RI1 1/20 0.30
SLC22A12 Q96S37 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
SCHEMBL18369540 0.89 MAPT (0.39) NPC1MAPTF11DGAT1KLKB1
SCHEMBL30690630 0.86 NPC1 (0.39) NPC1MAPTF11DGAT1MGAM
SCHEMBL18369539 0.82 MAPT (0.36) NPC1MAPTF11DGAT1
SCHEMBL18422264 0.80 NPC1 (0.42) NPC1MAPTF11DGAT1KLKB1
SCHEMBL30690764 0.79 CHEK1 (0.39) NPC1MAPTDGAT1
SCHEMBL18369614 0.79 MAPT (0.33) NPC1MAPTDGAT1
SCHEMBL21818822 0.79 ADORA3 (0.38) NPC1MAPTDGAT1MGAMKLKB1
SCHEMBL12670986 0.78 DGAT1 (0.39) NPC1MAPTDGAT1MGAMKLKB1
SCHEMBL30285039 0.78 DGAT1 (0.39) NPC1MAPTDGAT1MGAMKLKB1
SCHEMBL30690792 0.77 PIK3CD (0.34) NPC1MAPT

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-20190002437-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2019-01-03 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-20190002437-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 NPC1 959/4885MAPT 2802/4885F11 107/4885

“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.