SCHEMBL5756074

SCHEMBL5756074

Fc1ccc(-c2cnc(Cc3ccc(C(F)(F)F)cc3)[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 2/20 0.49
TRPV1 Q8NER1 1/20 0.48
NPY5R Q15761 1/20 0.45
SSTR3 P32745 2/20 0.45
HPGDS O60760 2/20 0.45
MCHR1 Q99705 1/20 0.44
PDE2A O00408 1/20 0.42
PDE10A Q9Y233 2/20 0.42
SCN10A Q9Y5Y9 2/20 0.40
CCNB2 O95067 1/20 0.40
CDK1 P06493 1/20 0.40
CCNB1 P14635 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
CCNB3 Q8WWL7 1/20 0.40
VNN1 O95497 1/20 0.39

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
SCHEMBL5758675 0.94 SCN2A (0.54) SCN2ATRPV1NPY5RSSTR3HPGDS
SCHEMBL5758137 0.88 SCN2A (0.62) SCN2ATRPV1NPY5RSSTR3HPGDS
SCHEMBL5756347 0.82 NPY5R (0.47) SCN2ATRPV1NPY5RSSTR3HPGDS
SCHEMBL5758399 0.81 SCN2A (0.47) SCN2ATRPV1NPY5RSSTR3HPGDS
SCHEMBL25303515 0.78 SCN2A (0.55) SCN2ATRPV1NPY5RSSTR3PDE10A
SCHEMBL25833757 0.78 SCN2A (0.55) SCN2ATRPV1NPY5RSSTR3PDE10A
SCHEMBL5755506 0.77 PDE10A (0.41) NPY5RSSTR3HPGDSPDE10ASCN10A
Bromide SCHEMBL16210189 0.77 SCN2A (0.54) SCN2ATRPV1NPY5RSSTR3PDE10A
SCHEMBL8196736 0.75 KIF11 (0.43) SCN2ATRPV1
Hydrochloric Acid SCHEMBL8196875 0.74 MAOB (0.44) SCN2A

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
EP-1194144-B1 ANTIBACTERIAL COMPOUNDS AFFINIUM PHARM INC (CA) 2006-11-02 EP claimed
US-20030149089-A1 Antibacterial compounds SMITHKLINE BEECHAM CORPORATION 2003-08-07 US claimed
EP-1194144-B1 ANTIBACTERIAL COMPOUNDS AFFINIUM PHARM INC (CA) 2006-11-02 EP 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-20030149089-A1 Antibacterial compounds MRPL21, MRPS28, SPOUT1 SCN2A 1133/4885TRPV1 619/4885NPY5R 4061/4885

“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.