SCHEMBL3237287

SCHEMBL3237287

Cc1ccccc1C(=O)NC(c1ccccc1)C1(N(C)C)CCCC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 10/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
UTS2R Q9UKP6 1/20 0.43
SLC6A5 Q9Y345 1/20 0.42
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
P2RX7 Q99572 1/20 0.40

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
SCHEMBL3232935 0.91 SLC6A9 (0.47) SLC6A9CYP1A2CYP2D6CYP2C19UTS2R
SCHEMBL3230692 0.89 SLC6A9 (0.48) SLC6A9UTS2RSLC6A5
SCHEMBL3239525 0.88 UTS2R (0.43) SLC6A9UTS2RSLC6A5NPC1RAB9A
SCHEMBL3243792 0.88 POLB (0.47) SLC6A9UTS2RSLC6A5LMNA
SCHEMBL3230781 0.87 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL13780494 0.87 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL3244640 0.86 SLC6A9 (0.42) SLC6A9UTS2RSLC6A5HPGDLMNA
SCHEMBL3236131 0.86 ALDH1A1 (0.41) SLC6A9HPGDLMNA
SCHEMBL3239983 0.86 UTS2R (0.42) SLC6A9CYP2D6CYP2C19UTS2R
SCHEMBL3240563 0.85 KMT2A (0.49) SLC6A9HPGDNPC1

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 7 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
WO-2006067423-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-20080287547-A1 Glycine Transport Inhibitors SLC18A2, SLC6A5, SLC1A2 SLC6A9 13/4885CYP1A2 982/4885CYP2D6 443/4885

“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.