SCHEMBL4938129

SCHEMBL4938129

CC1CCCCN1c1ccc(S(C)(=O)=O)cc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.54
LMNA P02545 2/20 0.46
SLC6A9 P48067 1/20 0.43
PKM P14618 1/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP3A4 P08684 1/20 0.40
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL4937036 0.87 GFER (0.51) GFERLMNASLC6A9TSHRHSD17B10
SCHEMBL11097632 0.81 GFER (0.57) GFERLMNACA1CA2TSHR
SCHEMBL11107477 0.81 GFER (0.81) GFERPKMHSD17B10HPGDMEN1
SCHEMBL11106979 0.81 GFER (0.57) GFERHPGDSMN1; SMN2MEN1KMT2A
SCHEMBL1813356 0.80 PKM (0.62) LMNASLC6A9PKMTSHRHSD17B10
SCHEMBL1672019 0.79 HTT (0.65) GFERLMNAHPGDSMN1; SMN2MEN1
SCHEMBL3931311 0.79 PKM (0.64) LMNASLC6A9PKMTSHRHPGD
SCHEMBL4937484 0.77 SLC6A9 (0.53) LMNASLC6A9CA12CA1CA2
SCHEMBL6500795 0.75 SLC6A9 (0.69) SLC6A9
SCHEMBL3916636 0.74 SLC6A9 (0.47) LMNASLC6A9PKMSMN1; SMN2GAA

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-20080090822-A1 Piperazine Derivatives As Glyt 1 Inhibitors GLAXO GROUP LIMITED 2008-04-17 US disclosed
EP-1856077-A1 PIPERAZINE DERIVATIVES AS GLYT1 INHIBITORS GLAXO GROUP LIMITED (GB) 2007-11-21 EP disclosed
WO-2006094843-A1 PIPERAZINE DERIVATIVES AS GLYT1 INHIBITORS GLAXO GROUP LIMITED (GB) 2006-09-14 WO 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-20080090822-A1 Piperazine Derivatives As Glyt 1 Inhibitors SLC6A7, SLC6A5, SLC1A2 GFER 2475/4885LMNA 4438/4885SLC6A9 22/4885

“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.