SCHEMBL3037837

SCHEMBL3037837

Cc1cccc(C(NC(=O)c2c(C)cccc2C)C2(N(C)C)CCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 16/20 0.47
SLC6A5 Q9Y345 1/20 0.45
LMNA P02545 1/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C19 P33261 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2C9 P11712 1/20 0.40
HDAC4 P56524 1/20 0.37

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
SCHEMBL31676491 0.89 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL3230781 0.89 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL13780494 0.89 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL3030343 0.88 SLC6A9 (0.46) SLC6A9SLC6A5CYP3A4CYP2C19CYP2C9
SCHEMBL3038506 0.88 SLC6A9 (0.46) SLC6A9SLC6A5CYP2C19CYP2C9
SCHEMBL3034321 0.88 SLC6A9 (0.49) SLC6A9SLC6A5ALDH1A1
SCHEMBL3034261 0.86 SLC6A9 (0.44) SLC6A9SLC6A5ALDH1A1
SCHEMBL3030679 0.85 SLC6A2 (0.45) SLC6A9SLC6A5
SCHEMBL3044646 0.85 SLC6A9 (0.44) SLC6A9SLC6A5CYP2C19CYP2C9HDAC4
SCHEMBL3236708 0.84 SLC6A9 (0.48) SLC6A9SLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100216837-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2010-08-26 US disclosed
US-20100216837-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2010-08-26 US disclosed
US-20100216837-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2010-08-26 US disclosed
WO-2006067414-A2 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-20100216837-A1 GLYCINE TRANSPORT INHIBITORS SLC18A2, SLC6A5, SLC1A2 SLC6A9 13/4885SLC6A5 2/4885LMNA 4455/4885

“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.