SCHEMBL5359677

SCHEMBL5359677

CC(C)(C)OC(=O)C1(NN)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
DGAT1 O75907 1/20 0.31
GAA P10253 1/20 0.31
JAK3 P52333 1/20 0.31
EPHX1 P07099 2/20 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
SCHEMBL5227332 0.98 NPSR1 (0.33) MAPTALDH1A1L3MBTL1NPSR1DGAT1
SCHEMBL28067161 0.90 DGAT1 (0.34) DGAT1
SCHEMBL15461486 0.80 MAPT (0.34) MAPTALDH1A1L3MBTL1NPSR1DGAT1
Hydrochloric Acid SCHEMBL25233263 0.79 MAPT (0.49) MAPTALDH1A1L3MBTL1NPSR1
SCHEMBL4734782 0.78 MAPT (0.47) MAPTALDH1A1L3MBTL1NPSR1
SCHEMBL15461474 0.78 NPSR1 (0.32) MAPTALDH1A1L3MBTL1NPSR1DGAT1
SCHEMBL1782571 0.76 MME (0.33) MAPTALDH1A1L3MBTL1EPHX1
SCHEMBL5389558 0.75 MME (0.36) MAPTALDH1A1L3MBTL1GAA
SCHEMBL3525418 0.75 CA12 (0.42) MAPTALDH1A1L3MBTL1NPSR1DGAT1
Water SCHEMBL6244439 0.75 MME (0.32) MAPTALDH1A1L3MBTL1EPHX1

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-20070167493-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2007-07-19 US disclosed
US-7223777-B2 Compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. (IN) 2007-05-29 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-20070167493-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof AGER, GLA, F12 MAPT 4043/4885ALDH1A1 226/4885L3MBTL1 3323/4885

“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.