SCHEMBL3238200

SCHEMBL3238200

Cc1cc(F)cc(C)c1C(=O)NC(c1ccccc1)C(C)(C)N1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 1/20 0.39
SLC6A9 P48067 7/20 0.38
ITGB3 P05106 4/20 0.37
ITGB1 P05556 4/20 0.37
ITGAV P06756 4/20 0.37
ITGA5 P08648 4/20 0.37
ITGB5 P18084 4/20 0.37
LMNA P02545 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 1/20 0.36
NPC1 O15118 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SLC6A5 Q9Y345 1/20 0.35
ITGA2B P08514 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL3233025 0.91 SLC6A9 (0.39) SLC6A9ITGB3ITGB1ITGAVITGA5
SCHEMBL3245881 0.90 SLC6A9 (0.39) SLC6A9LMNASMN1; SMN2MEN1KMT2A
SCHEMBL3241373 0.89 ALDH1A1 (0.39) SLC6A9ITGB3LMNASMN1; SMN2MEN1
SCHEMBL3243734 0.88 SLC6A9 (0.48) SLC6A9LMNASMN1; SMN2MEN1KMT2A
SCHEMBL3238301 0.87 SLC6A9 (0.47) SLC6A9LMNAMEN1KMT2ANPC1
SCHEMBL3234880 0.87 CCR5 (0.41) CCR5SLC6A9LMNASMN1; SMN2MEN1
SCHEMBL3244977 0.84 TACR1 (0.39) SLC6A9
SCHEMBL3239948 0.84 KMT2A (0.38) ITGB3LMNASMN1; SMN2MEN1KMT2A
SCHEMBL3237806 0.83 ROCK2 (0.43) SLC6A9LMNAMEN1KMT2AALDH1A1
SCHEMBL26840793 0.82 RXFP1 (0.38) SLC6A9LMNASMN1; SMN2MEN1KMT2A

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 5 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

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 CCR5 4457/4885SLC6A9 13/4885ITGB3 4848/4885

“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.