SCHEMBL6928646

SCHEMBL6928646

CCN1CCN(c2ccc(-c3nc(-c4ccc(OC)c(F)c4)c[nH]3)cn2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 2/20 0.50
MAP4K1 Q92918 4/20 0.42
IL2 P60568 2/20 0.42
LCK P06239 1/20 0.41
MAP4K3 Q8IVH8 1/20 0.41
SYK P43405 2/20 0.41
TLR9 Q9NR96 1/20 0.40
TLR8 Q9NR97 1/20 0.40
RET P07949 3/20 0.40
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
NPC1 O15118 3/20 0.38
ALDH1A1 P00352 3/20 0.38
TDO2 P48775 1/20 0.38
KIT P10721 1/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL6926990 0.91 ZAP70 (0.52) ZAP70MAP4K1IL2SYKTLR9
SCHEMBL6927694 0.87 MAP4K1 (0.53) ZAP70MAP4K1IL2LCKTLR9
SCHEMBL6921861 0.85 MAP4K1 (0.42) MAP4K1IL2LCKMAP4K3RET
SCHEMBL6925946 0.84 TDO2 (0.45) ZAP70SYKRETALDH1A1TDO2
SCHEMBL6928854 0.84 MGLL (0.44) ZAP70LCKSYKRETTDO2
SCHEMBL6925622 0.81 HRH3 (0.45) ZAP70SYKRETALDH1A1KIT
SCHEMBL6928035 0.81 CNR2 (0.48) ZAP70SYKRETKDM4EGAA
SCHEMBL6925614 0.80 TLR8 (0.60) ZAP70MAP4K1IL2TLR9TLR8
SCHEMBL6925715 0.80 MAP4K1 (0.56) ZAP70MAP4K1IL2TLR9TLR8
SCHEMBL6923696 0.80 RET (0.43) ZAP70SYKRETNPC1KIT

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 ZAP70 3055/4885MAP4K1 1027/4885IL2 4689/4885

“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.