SCHEMBL3469975

SCHEMBL3469975

CC1CN(c2cccc(C(=O)O)n2)CC(C)N1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
ACMSD Q8TDX5 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TTR P02766 1/20 0.42
GNE Q9Y223 1/20 0.41
SORD Q00796 6/20 0.41
PRKCQ Q04759 3/20 0.39
HSD11B1 P28845 3/20 0.39
LMNA P02545 1/20 0.39
GRM1 Q13255 1/20 0.39
HSD17B14 Q9BPX1 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
SCHEMBL16834258 0.82 ALDH1A1 (0.47) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL20055871 0.82 ALDH1A1 (0.47) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL31480075 0.79 TTR (0.47) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL20031456 0.78 KDM4E (0.47) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL2638000 0.77 HTR3A (0.58) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL9005458 0.77 PRKCQ (0.62) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL3466851 0.76 CNR1 (0.48) TSHR
Hydrochloric Acid SCHEMBL3466386 0.76 HTR3A (0.57) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL31469904 0.75 ALOX5 (0.47) SORDGRM1
SCHEMBL31383621 0.75 ALOX5 (0.47) SORDGRM1

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
EP-2265600-A1 PYRIDINYL AMIDES FOR THE TREATMENT OF CNS AND METABOLIC DISORDERS Pfizer Inc. (US) 2010-12-29 EP disclosed
WO-2009098576-A1 PYRIDINYL AMIDES FOR THE TREATMENT OF CNS AND METABOLIC DISORDERS PFIZER INC. (US) 2009-08-13 WO disclosed
US-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders PFIZER INC. 2009-08-06 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-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders HTR6, HTR5A, TPH1 KDM4E 2255/4885ALOX15 660/4885TSHR 74/4885

“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.