SCHEMBL15420706

SCHEMBL15420706

C[C@H](NC1CC2CCC(O2)C1C(=O)O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.48
SLC6A4 P31645 4/20 0.48
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TFPI2 P48307 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL21795656 0.85 SLC6A3 (0.47) SLC6A3SLC6A4ALDH1A1
SCHEMBL21795655 0.85 SLC6A3 (0.47) SLC6A3SLC6A4ALDH1A1
SCHEMBL9546969 0.74 LMNA (0.62) GAAALDH1A1LMNARECQL
SCHEMBL9547063 0.74 LMNA (0.62) GAAALDH1A1LMNARECQL
SCHEMBL6719058 0.69 RECQL (0.54) GAAL3MBTL1LMNARECQL
SCHEMBL3058008 0.69 GAA (0.57) GAAL3MBTL1LMNARECQL
SCHEMBL3052941 0.69 GAA (0.57) GAAL3MBTL1LMNARECQL
SCHEMBL6517000 0.69 GAA (0.57) GAAL3MBTL1LMNARECQL
Hydrochloric Acid SCHEMBL6527528 0.68 GAA (0.55) GAAL3MBTL1LMNARECQL
SCHEMBL30672700 0.68 GAA (0.44) GAAL3MBTL1LMNARECQL

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
EP-2694472-B1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2020-03-11 EP disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 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-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF GRIN2A, GRIN2B, SLC1A2 SLC6A3 17/4885SLC6A4 10/4885GAA 547/4885

“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.