SCHEMBL8260689

SCHEMBL8260689

COc1cccc(C)c1C(=O)NC(c1ccc(F)cc1)C1(N(C)C)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 14/20 0.43
ATM Q13315 1/20 0.40
SLC6A5 Q9Y345 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
KMT2A Q03164 1/20 0.37
P2RX7 Q99572 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
SCHEMBL3233042 0.92 SLC6A9 (0.52) SLC6A9ATMSLC6A5TAS1R3TAS1R1
SCHEMBL3034243 0.91 SLC6A9 (0.47) SLC6A9SLC6A5KMT2A
SCHEMBL3023849 0.85 SLC6A9 (0.46) SLC6A9SLC6A5KMT2AP2RX7
SCHEMBL3240768 0.85 SLC6A9 (0.58) SLC6A9SLC6A5KMT2A
SCHEMBL3034321 0.82 SLC6A9 (0.49) SLC6A9SLC6A5
SCHEMBL3044646 0.81 SLC6A9 (0.44) SLC6A9SLC6A5
SCHEMBL13780494 0.81 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL31676491 0.81 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL3230781 0.81 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL3038506 0.81 SLC6A9 (0.46) SLC6A9SLC6A5KMT2A

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-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 13/4885ATM 2523/4885SLC6A5 2/4885

“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.