SCHEMBL6924646

SCHEMBL6924646

CC(C)CN1CCN(c2ccc(-c3nc(-c4cccc(Cl)c4)c[nH]3)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.47
MGLL Q99685 1/20 0.42
RET P07949 4/20 0.42
TLR9 Q9NR96 1/20 0.42
TLR8 Q9NR97 1/20 0.42
DYRK3 O43781 1/20 0.40
CCNT1 O60563 1/20 0.40
CDK9 P50750 1/20 0.40
DYRK1A Q13627 1/20 0.40
DYRK2 Q92630 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
KDM4E B2RXH2 2/20 0.38
PKM P14618 1/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AURKA O14965 1/20 0.38
KDR P35968 1/20 0.38
AURKB Q96GD4 1/20 0.38
MAPT P10636 1/20 0.38
PTPN11 Q06124 1/20 0.37

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
SCHEMBL6920570 0.90 RET (0.42) CNR2MGLLRETTLR9TLR8
SCHEMBL6926009 0.89 CNR2 (0.50) CNR2MGLLRETDYRK3CCNT1
SCHEMBL6923909 0.88 CNR2 (0.46) CNR2MGLLRETTLR9TLR8
SCHEMBL6926989 0.87 MGLL (0.43) CNR2MGLLRETTLR9TLR8
SCHEMBL6923470 0.87 CDK1 (0.41) DYRK3CCNT1CDK9DYRK1ADYRK2
SCHEMBL6924524 0.86 CNR2 (0.53) CNR2MGLLRETDGAT1KCNH2
SCHEMBL6924555 0.85 CNR2 (0.49) CNR2RETTLR9TLR8PTPN11
SCHEMBL6928322 0.85 CNR2 (0.46) CNR2MGLLRETDYRK3CCNT1
SCHEMBL6928907 0.84 CNR2 (0.46) CNR2RETTLR9TLR8AURKA
SCHEMBL6927079 0.84 TDO2 (0.43) RETTLR9TLR8AURKA

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 CNR2 122/4885MGLL 234/4885RET 1562/4885

“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.