SCHEMBL3607271

SCHEMBL3607271

CC(C)(C)OC(=O)N1CCCC([C@@](C)(OCCO[Si](C)(C)C(C)(C)C)c2cccc(Cl)c2)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
STS P08842 1/20 0.41
ANO1 Q5XXA6 1/20 0.39
REN P00797 5/20 0.39
USP30 Q70CQ3 3/20 0.39
TP53 P04637 3/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 2/20 0.38
ACKR3 P25106 1/20 0.38
GRM5 P41594 1/20 0.37

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
SCHEMBL3607274 1.00 SMN1; SMN2 (0.42) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL4971318 0.91 REN (0.39) SMN1; SMN2REN
SCHEMBL3609024 0.88 FNTA (0.39) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL3609025 0.88 FNTA (0.39) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL3620859 0.88 REN (0.43) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL3620857 0.88 REN (0.43) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL13502919 0.88 REN (0.43) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL3615882 0.87 FNTA (0.42) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL3615881 0.87 FNTA (0.42) SMN1; SMN2FNTAFNTBSTSANO1
SCHEMBL3605863 0.84 REN (0.54) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8487108-B2 Piperidinyl carbamate intermediates for the synthesis of aspartic protease inhibitors VITAE PHARMACEUTICALS, INC. (US) 2013-07-16 US disclosed
EP-1966139-B1 ASPARTIC PROTEASE INHIBITORS VITAE PHARMACEUTICALS INC (US) 2011-12-21 EP disclosed
US-20100048636-A1 Aspartic Protease Inhibitors VITAE PHARMACEUTICALS, INC. 2010-02-25 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-20100048636-A1 Aspartic Protease Inhibitors DNPEP, PEPD, SERPINB1 SMN1; SMN2 1372/4885FNTA 1668/4885FNTB 3578/4885

“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.