SCHEMBL6920718

SCHEMBL6920718

CC(C)CN1CCN(c2cc(-c3nc(-c4ccc(F)c(Cl)c4)c[nH]3)ccn2)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.40
WNT1 P04628 1/20 0.40
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
PTPN11 Q06124 3/20 0.39
TRPV3 Q8NET8 1/20 0.38
NMT1 P30419 7/20 0.37
DRD4 P21917 2/20 0.35
DRD2 P14416 1/20 0.35
PRKD1 Q15139 1/20 0.35
KMO O15229 1/20 0.35
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
MGLL Q99685 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
SCHEMBL6925150 0.92 WNT1 (0.42) PIK3C3WNT1GSK3BDYRK1ATRPV3
SCHEMBL6927511 0.92 WNT1 (0.41) PIK3C3WNT1GSK3BDYRK1APTPN11
SCHEMBL6927962 0.91 WNT1 (0.44) PIK3C3WNT1GSK3BDYRK1ANMT1
SCHEMBL6925663 0.90 PTPN11 (0.42) PIK3C3WNT1GSK3BDYRK1APTPN11
SCHEMBL6926989 0.89 MGLL (0.43) DYRK1APTPN11TLR9TLR8MGLL
SCHEMBL6924959 0.89 WNT1 (0.40) PIK3C3WNT1GSK3BDYRK1ATRPV3
SCHEMBL6925237 0.89 WNT1 (0.42) WNT1GSK3BDYRK1ATRPV3DRD4
SCHEMBL6920697 0.88 PIK3C3 (0.43) PIK3C3WNT1GSK3BDYRK1ANMT1
SCHEMBL6925647 0.88 TLR9 (0.45) PIK3C3WNT1GSK3BDYRK1APTPN11
SCHEMBL6925707 0.87 ITGB2 (0.44) WNT1GSK3BDYRK1A

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-6355635-B1 IMIDAZOLEBENZENE, IMIDAZOLEPYRIDINE COMPOUNDS FOR TREATMENT OF OBESITY PFIZER INC. 2002-03-12 US claimed
US-20010039277-A1 Compounds for the treatment of obesity ELLIOTT RICHARD L (US) 2001-11-08 US claimed
WO-2000066578-A1 COMPOUNDS FOR THE TREATMENT OF OBESITY PFIZER PRODUCTS INC. (US) 2000-11-09 WO claimed
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
WO-2000066578-A1 COMPOUNDS FOR THE TREATMENT OF OBESITY PFIZER PRODUCTS INC. (US) 2000-11-09 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-20010039277-A1 Compounds for the treatment of obesity NPY1R, NPY4R, NPY2R PIK3C3 4567/4885WNT1 3698/4885GSK3B 1100/4885

“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.