SCHEMBL1244925

SCHEMBL1244925

COC(=O)c1c(F)c2sccc2n1COCC[Si](C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.37
TP53 P04637 3/20 0.37
NPC1 O15118 1/20 0.36
THRB P10828 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TSHR P16473 1/20 0.33
DGAT1 O75907 1/20 0.33
STAT1 P42224 1/20 0.33
KLKB1 P03952 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.33
F11 P03951 1/20 0.32
FEN1 P39748 1/20 0.32

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
SCHEMBL5129680 0.90 NPC1 (0.37) MAPTNPC1FEN1
SCHEMBL1243792 0.76 MAPT (0.58) MAPTTP53THRBL3MBTL1TSHR
SCHEMBL30725440 0.73 NPC1 (0.33) MAPTNPC1DGAT1KLKB1F11
SCHEMBL6719573 0.71 GRIK1 (0.47) MAPTTP53NPC1L3MBTL1KDM4E
SCHEMBL25104433 0.71 F2RL1 (0.35) NPC1L3MBTL1DGAT1KDM4EHSD17B10
SCHEMBL22112683 0.70 THRB (0.38) MAPTTP53NPC1THRBDGAT1
SCHEMBL25258361 0.69 F11 (0.39) MAPTNPC1THRBL3MBTL1DGAT1
SCHEMBL25104434 0.69 DGAT1 (0.38) NPC1DGAT1KLKB1KDM4ESMN1; SMN2
SCHEMBL15050722 0.69 NPC1 (0.40) MAPTNPC1TSHRDGAT1KLKB1
SCHEMBL1244659 0.68 POLB (0.54) MAPTTP53THRBL3MBTL1TSHR

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-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-03 US disclosed
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-03 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 (2 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-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase DAO, DDO, AOX1 MAPT 2847/4885TP53 4286/4885NPC1 4688/4885
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE DAO, DDO, AOX1 MAPT 2384/4885TP53 3597/4885NPC1 4332/4885

“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.