SCHEMBL3902154

SCHEMBL3902154

CN(C)C(C)(C)C(NC(=O)c1c(Cl)ccc(C(F)(F)F)c1Cl)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 1/20 0.39
LMNA P02545 2/20 0.38
CASR P41180 1/20 0.38
SLC6A9 P48067 6/20 0.37
CTSS P25774 3/20 0.37
P2RX7 Q99572 1/20 0.36
KLRK1 P26718 1/20 0.36
MICA Q29983 1/20 0.36
CTSK P43235 2/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HDAC3 O15379 2/20 0.35
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35

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
SCHEMBL3902170 0.86 LMNA (0.44) LMNASLC6A9P2RX7ALDH1A1SMN1; SMN2
SCHEMBL3904027 0.83 CTSS (0.56) SLC6A9CTSSP2RX7CTSK
SCHEMBL3901504 0.81 LMNA (0.43) LMNAALDH1A1SMN1; SMN2
SCHEMBL3240164 0.81 SLC6A9 (0.45) CLCN2LMNACASRSLC6A9CTSS
SCHEMBL3906111 0.79 UTS2R (0.50) LMNASLC6A9ALDH1A1SMN1; SMN2
SCHEMBL3904017 0.78 LMNA (0.40) LMNASLC6A9ALDH1A1SMN1; SMN2
SCHEMBL3914045 0.78 LMNA (0.40) LMNASLC6A9ALDH1A1SMN1; SMN2
SCHEMBL3903962 0.78 TACR1 (0.41)
SCHEMBL3910586 0.78 CRHR1 (0.46) LMNAKLRK1MICAALDH1A1SMN1; SMN2
SCHEMBL3902029 0.77 ITGB1 (0.43) LMNASLC6A9ALDH1A1SMN1; 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 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 CLCN2 960/4885LMNA 4455/4885CASR 2728/4885

“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.