SCHEMBL6925936

SCHEMBL6925936

FC(F)(F)Oc1cccc(-c2c[nH]c(-c3ccnc(N4CCN(CC5CC5)CC4)c3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.47
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4D Q08499 1/20 0.40
USP30 Q70CQ3 1/20 0.39
RIPK3 Q9Y572 1/20 0.38
PIM1 P11309 2/20 0.38
PDE10A Q9Y233 2/20 0.38
ABL1 P00519 1/20 0.37
DPP4 P27487 1/20 0.37
DGAT2 Q96PD7 1/20 0.36
SLC6A7 Q99884 1/20 0.36
ACP1 P24666 1/20 0.36
NPY5R Q15761 1/20 0.36
GSK3B P49841 1/20 0.36
MAPK14 Q16539 1/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL6925301 0.87 MTOR (0.45) KDM4EL3MBTL1
SCHEMBL6928139 0.86 SCN9A (0.47) SCN9APDE4APDE4BPDE4DUSP30
SCHEMBL6921236 0.84 DRD2 (0.38) PIM1MAPK14
SCHEMBL6928029 0.84 SMG1 (0.43) PDE4AKDM4E
SCHEMBL6927463 0.83 KDM4E (0.40) SCN9AABL1KDM4EL3MBTL1
SCHEMBL6926804 0.82 TRPA1 (0.39) MAPK14
SCHEMBL6928150 0.81 SMG1 (0.45) PDE4APDE4BPDE4DUSP30
SCHEMBL6924877 0.81 PIK3C3 (0.38)
SCHEMBL6927160 0.80 DRD2 (0.43)
SCHEMBL6924862 0.80 PIM1 (0.41) PIM1

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
US-6514966-B2 Neuropeptide Y antagonists such as 2-chloro-5-(4-(3,4-dich loro-phenyl)-1H-imidazol-2-yl)-pyridine PFIZER INC. 2003-02-04 US disclosed
US-6355635-B1 IMIDAZOLEBENZENE, IMIDAZOLEPYRIDINE COMPOUNDS FOR TREATMENT OF OBESITY PFIZER INC. 2002-03-12 US disclosed
US-20010039277-A1 Compounds for the treatment of obesity ELLIOTT RICHARD L (US) 2001-11-08 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-20010039277-A1 Compounds for the treatment of obesity NPY1R, NPY4R, NPY2R SCN9A 2783/4885PDE4A 654/4885PDE4B 670/4885

“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.