SCHEMBL3245099

SCHEMBL3245099

CCC(CC)(C(NC(=O)c1c(C)cc(C)cc1C)c1ccccc1)N(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 5/20 0.40
ALDH1A1 P00352 1/20 0.40
ITGB1 P05556 2/20 0.38
ITGA4 P13612 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
SLC6A9 P48067 2/20 0.36
MAPT P10636 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
ITGB3 P05106 1/20 0.35
ITGAV P06756 1/20 0.35
ITGA5 P08648 1/20 0.35
RIPK1 Q13546 1/20 0.35
OPRM1 P35372 1/20 0.34
PYGL P06737 2/20 0.34
CYP2C9 P11712 2/20 0.34

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
SCHEMBL3238502 0.90 L3MBTL1 (0.47) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL3906640 0.84 LMNA (0.42) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL3232912 0.82 ITGB1 (0.41) SMN1; SMN2LMNAALDH1A1ITGB1ITGA4
SCHEMBL3244606 0.81 TAS1R3 (0.44) MEN1KMT2AALDH1A1L3MBTL1SLC6A9
SCHEMBL3243967 0.78 KLRK1 (0.42) SMN1; SMN2MEN1KMT2AALDH1A1CYP2C9
SCHEMBL13662337 0.77 LMNA (0.43) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL3237851 0.77 SMN1; SMN2 (0.40) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL3237956 0.77 L3MBTL1 (0.46) SMN1; SMN2LMNAALDH1A1L3MBTL1SLC6A9
SCHEMBL3238144 0.75 UTS2R (0.50) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL3905654 0.74 LMNA (0.42) SMN1; SMN2MEN1KMT2ALMNAALDH1A1

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
US-7745642-B2 Glycine transport inhibitors GLAXO GROUP LIMITED (GB) 2010-06-29 US disclosed
US-7745642-B2 Glycine transport inhibitors GLAXO GROUP LIMITED (GB) 2010-06-29 US disclosed
US-7745642-B2 Glycine transport inhibitors GLAXO GROUP LIMITED (GB) 2010-06-29 US disclosed
US-20080287547-A1 Glycine Transport Inhibitors GLAXO GROUP LIMITED (GB) 2008-11-20 US disclosed
US-20080287547-A1 Glycine Transport Inhibitors GLAXO GROUP LIMITED (GB) 2008-11-20 US disclosed
US-20080287547-A1 Glycine Transport Inhibitors GLAXO GROUP LIMITED (GB) 2008-11-20 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-20080287547-A1 Glycine Transport Inhibitors SLC18A2, SLC6A5, SLC1A2 SMN1; SMN2 2457/4885MEN1 2501/4885KMT2A 1871/4885

“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.