SCHEMBL3103941

SCHEMBL3103941

CCOC(=O)C(CC(=O)Nc1ccccc1)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
GAA P10253 4/20 0.53
HPGD P15428 4/20 0.53
RAB9A P51151 3/20 0.53
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 4/20 0.48
NPC1 O15118 2/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
NOTUM Q6P988 1/20 0.47
PIN1 Q13526 1/20 0.46
TP53 P04637 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL3085196 0.79 MAPT (0.60) MAPTGAAHPGDSMN1; SMN2ALDH1A1
SCHEMBL679125 0.77 TSHR (0.69) MAPTGAAHPGDSMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL7130171 0.76 TSHR (0.67) MAPTGAAHPGDRAB9ASMN1; SMN2
SCHEMBL4110940 0.74 MAPT (0.86) MAPTGAAHPGDRAB9ASMN1; SMN2
Ethyl Phenylcarbamate SCHEMBL11593824 0.74 RAB9A (0.75) MAPTGAAHPGDRAB9ASMN1; SMN2
Ethyl Phenylcarbamate SCHEMBL264865 0.74 RAB9A (0.75) MAPTGAAHPGDRAB9ASMN1; SMN2
SCHEMBL22648544 0.74 MAPT (0.59) MAPTGAAHPGDRAB9ASMN1; SMN2
SCHEMBL5592685 0.74 MAPT (0.63) MAPTGAAHPGDRAB9ASMN1; SMN2
SCHEMBL14791253 0.74 MAPT (0.49) MAPTGAAHPGDRAB9ASMN1; SMN2
SCHEMBL9305595 0.74 HSD11B1 (0.56) MAPTGAAHPGDRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2172450-B9 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2014-10-08 EP disclosed
EP-2172450-B1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2013-10-16 EP disclosed
US-8461209-B2 Malonic acid sulfonamide derivative and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-06-11 US disclosed
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-09 US disclosed
EP-2172450-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2010-04-07 EP 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-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF REN, AGTR2, AGTR1 MAPT 2813/4885GAA 272/4885HPGD 1736/4885

“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.