SCHEMBL3059529

SCHEMBL3059529

Cc1ccc2c(nc(C(=O)O)n2COCC[Si](C)(C)C)c1C

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
PTGER4 P35408 11/20 0.35
MAPT P10636 1/20 0.35
KLKB1 P03952 1/20 0.33
F11 P03951 1/20 0.33
EGLN1 Q9GZT9 1/20 0.32
DGAT1 O75907 1/20 0.31
PRF1 P14222 1/20 0.31

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
SCHEMBL638405 0.79 PTGER4 (0.44) NPC1PTGER4MAPT
SCHEMBL5952186 0.76 NPC1 (0.42) NPC1PTGER4MAPTKLKB1F11
SCHEMBL3059528 0.74 NPC1 (0.41) NPC1PTGER4MAPTKLKB1F11
SCHEMBL30889616 0.74 NPC1 (0.36) NPC1MAPTKLKB1F11DGAT1
SCHEMBL1316068 0.73 NPC1 (0.35) NPC1MAPTKLKB1F11DGAT1
SCHEMBL20553221 0.70 NPC1 (0.36) NPC1MAPTF11DGAT1
SCHEMBL20551555 0.70 NPC1 (0.36) NPC1PTGER4MAPTDGAT1
SCHEMBL12381935 0.70 NPC1 (0.37) NPC1MAPTKLKB1F11DGAT1
SCHEMBL1314051 0.70 NPC1 (0.35) NPC1MAPTKLKB1F11DGAT1
SCHEMBL5374515 0.70 NPC1 (0.37) NPC1MAPTKLKB1F11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7790715-B2 Organic compounds NOVARTIS AG (CH) 2010-09-07 US disclosed
US-20070010511-A1 Organic compounds NOVARTIS PHARMA AG (CH) 2007-01-11 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-20070010511-A1 Organic compounds REN, ACE, ACE2 NPC1 794/4885PTGER4 74/4885MAPT 2397/4885

“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.