SCHEMBL3901980

SCHEMBL3901980

Cc1c(Br)cccc1C(=O)NC(c1ccccc1)C(C)(C)N(C)C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
LMNA P02545 5/20 0.39
HPGD P15428 3/20 0.39
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP26A1 O43174 2/20 0.37
UTS2R Q9UKP6 3/20 0.36
CCR6 P51684 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL3906053 0.91 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL3902328 0.89 UTS2R (0.46) ALDH1A1MEN1KMT2ATDP1LMNA
SCHEMBL3905781 0.86 UTS2R (0.50) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL3903980 0.86 MEN1 (0.42) ALDH1A1MEN1KMT2AL3MBTL1POLB
SCHEMBL3917527 0.85 POLB (0.41) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL3908046 0.84 CTSS (0.52) LMNA
SCHEMBL3907168 0.84 UTS2R (0.45) ALDH1A1MEN1KMT2AL3MBTL1LMNA
SCHEMBL3903930 0.84 SLC6A9 (0.41) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL3903926 0.84 LMNA (0.40) ALDH1A1MEN1KMT2AL3MBTL1LMNA
SCHEMBL3903958 0.83 MEN1 (0.41) ALDH1A1MEN1KMT2AL3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1838663-B1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LTD (GB) 2009-01-21 EP claimed
US-20090270510-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2009-10-29 US disclosed
US-20090270510-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2009-10-29 US disclosed
US-20090270510-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2009-10-29 US disclosed
EP-1838663-B1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LTD (GB) 2009-01-21 EP disclosed
WO-2006067417-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2006-06-29 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-20090270510-A1 GLYCINE TRANSPORT INHIBITORS SLC18A2, SLC6A5, SLC1A2 ALDH1A1 1358/4885MEN1 2710/4885KMT2A 1752/4885

“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.