SCHEMBL6924644

SCHEMBL6924644

CCC(C)C(C)N1CCN(c2cc(-c3nc(-c4cccc(Cl)c4)c[nH]3)ccn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMG1 Q96Q15 2/20 0.39
CDK1 P06493 1/20 0.39
CDK2 P24941 1/20 0.39
KMT2A Q03164 1/20 0.37
CNR2 P34972 1/20 0.36
PTPN11 Q06124 2/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
KARS1 Q15046 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAOB P27338 1/20 0.34
HTR6 P50406 1/20 0.34
MAPK14 Q16539 1/20 0.34
TLR9 Q9NR96 1/20 0.34

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
SCHEMBL6924320 0.93 SMG1 (0.39) SMG1CDK1CDK2KMT2ACNR2
SCHEMBL6925038 0.89 SMG1 (0.39) SMG1CDK1CDK2KMT2ACNR2
SCHEMBL6923494 0.86 CDK1 (0.38) SMG1CDK1CDK2KMT2ACNR2
SCHEMBL6921614 0.85 CDK1 (0.43) SMG1CDK1CDK2KMT2ACNR2
SCHEMBL6923498 0.85 CDK1 (0.39) SMG1CDK1CDK2KMT2ACNR2
SCHEMBL6923470 0.84 CDK1 (0.41) SMG1CDK1CDK2KMT2APTPN11
SCHEMBL6924886 0.83 ITGB2 (0.43) SMG1CDK1CDK2PTPN11MAPT
SCHEMBL6923488 0.80 KDM4E (0.39) SMG1CDK1CDK2KMT2APTPN11
SCHEMBL6927844 0.79 HRH3 (0.43) SMG1CDK1CDK2KMT2ACNR2
SCHEMBL6928029 0.79 SMG1 (0.43) SMG1CDK1CDK2KMT2ACNR2

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 SMG1 4380/4885CDK1 3513/4885CDK2 3887/4885

“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.