SCHEMBL10064844

SCHEMBL10064844

Cn1cnc(C(=O)N(Cc2cccc(C(F)(F)F)c2)C2CCSCC2)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 20/20 0.60
KCNH2 Q12809 15/20 0.60
SLC6A5 Q9Y345 11/20 0.60
CYP2D6 P10635 7/20 0.56
CYP3A4 P08684 4/20 0.53

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
SCHEMBL10064847 0.88 SLC6A9 (0.59) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL375014 0.81 SLC6A9 (0.56) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL10064845 0.78 SLC6A9 (0.53) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL380455 0.78 SLC6A9 (0.57) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL10081750 0.78 SLC6A9 (0.51) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL10081283 0.78 SLC6A9 (0.53) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL407459 0.77 SLC6A9 (0.54) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL8213349 0.77 SLC6A9 (0.75) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL375306 0.77 SLC6A9 (0.75) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4
SCHEMBL708328 0.77 SLC6A9 (0.76) SLC6A9KCNH2SLC6A5CYP2D6CYP3A4

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-8623898-B2 Glycine transporter inhibiting substances TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-01-07 US disclosed
US-8623898-B2 Glycine transporter inhibiting substances TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-01-07 US disclosed
US-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 US disclosed
US-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 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-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES SLC18A2, SLC1A2, SLC6A1 SLC6A9 8/4885KCNH2 1870/4885SLC6A5 4/4885

“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.