SCHEMBL5758378

SCHEMBL5758378

FC(F)(F)c1ccc(Cc2ncc(-c3ccc(Cl)cc3Cl)[nH]2)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.41
ALDH1A1 P00352 2/20 0.40
CNR2 P34972 3/20 0.40
DPP4 P27487 1/20 0.39
MAPT P10636 1/20 0.37
MDM2 Q00987 1/20 0.37
SLC6A4 P31645 1/20 0.36
GCGR P47871 1/20 0.36
MAPK14 Q16539 1/20 0.36
EGFR P00533 1/20 0.35
DAO P14920 1/20 0.35
HPGDS O60760 1/20 0.35
KDM4E B2RXH2 1/20 0.35
P2RX3 P56373 1/20 0.35

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
SCHEMBL5757230 0.85 CNR1 (0.42) CNR1ALDH1A1CNR2DPP4MAPT
SCHEMBL5758338 0.82 ADORA2A (0.43) CNR1ALDH1A1CNR2MAPTSLC6A4
SCHEMBL5757516 0.81 CXCR2 (0.47) CNR1ALDH1A1CNR2DPP4MAPT
SCHEMBL5756347 0.79 NPY5R (0.47) HPGDS
SCHEMBL5756845 0.78 SCN2A (0.44) DPP4EGFR
SCHEMBL5758675 0.77 SCN2A (0.54) HPGDS
SCHEMBL5757793 0.75 ALDH1A1 (0.45) CNR1ALDH1A1CNR2MAPTKDM4E
SCHEMBL5756074 0.73 SCN2A (0.49) HPGDS
SCHEMBL5758137 0.72 SCN2A (0.62) HPGDS
SCHEMBL5758399 0.71 SCN2A (0.47) MAPTHPGDS

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 6 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
US-6673941-B2 Disubstituted imidazoles useful in the treatment of bacterial infections AFFINIUM PHARMACEUTICALS, INC. (CA) 2004-01-06 US disclosed
US-20030149089-A1 Antibacterial compounds SMITHKLINE BEECHAM CORPORATION 2003-08-07 US disclosed
US-6559172-B1 Treatment of bacterial infections, particularly through the inhibition of FAB I. and antiobiotics SMITHKLINE BEECHAM CORPORATION 2003-05-06 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-20030149089-A1 Antibacterial compounds MRPL21, MRPS28, SPOUT1 CNR1 1387/4885ALDH1A1 388/4885CNR2 3107/4885

“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.