SCHEMBL3140786

SCHEMBL3140786

COC(=O)CCc1ccccc1OCCCCl

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.55
MAPT P10636 2/20 0.46
PPARG P37231 1/20 0.44
LTB4R Q15722 2/20 0.43
LTB4R2 Q9NPC1 2/20 0.43
TSHR P16473 1/20 0.42
HPGD P15428 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
DHFR P00374 1/20 0.42

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
SCHEMBL3266929 0.87 PPARD (0.54) PPARDMAPTPPARGLTB4RLTB4R2
SCHEMBL31155854 0.87 PPARD (0.54) PPARDMAPTPPARGLTB4RLTB4R2
SCHEMBL9122500 0.86 PPARD (0.53) PPARDPPARGLTB4RLTB4R2
SCHEMBL31155865 0.86 PPARD (0.53) PPARDMAPTPPARGLTB4RLTB4R2
SCHEMBL15927987 0.86 PPARG (0.60) PPARDMAPTPPARGLTB4RLTB4R2
SCHEMBL31155848 0.85 PPARD (0.52) PPARDMAPTPPARGLTB4RLTB4R2
SCHEMBL9119104 0.85 PPARD (0.52) PPARDMAPTPPARGLTB4RLTB4R2
SCHEMBL9121525 0.83 PPARD (0.51) PPARDPPARGLTB4RLTB4R2
SCHEMBL9118855 0.82 PPARD (0.50) PPARDPPARGLTB4RLTB4R2
SCHEMBL9121426 0.81 PPARD (0.49) PPARDPPARGLTB4RLTB4R2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081692-A1 Novel 1-Benzyl-4-Piperidinamines that are Useful in the Treatment of COPD and Asthma ASTRAZENECA AB (SE) 2010-04-01 US disclosed
CN-101351448-A Novel 1-benzyl-4-piperidinamines for the treatment of COPD and asthma ASTRAZENECA AB (SE) 2009-01-21 CN disclosed
EP-1945613-A1 NOVEL 1 -BENZYL-4-PIPERIDINAMINES THAT ARE USEFUL IN THE TREATMENT OF COPD AND ASTHMA AstraZeneca AB (SE) 2008-07-23 EP disclosed
WO-2007053082-A1 NOVEL 1 -BENZYL-4-PIPERIDINAMINES THAT ARE USEFUL IN THE TREATMENT OF COPD AND ASTHMA ASTRAZENECA AB (SE) 2007-05-10 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-20100081692-A1 Novel 1-Benzyl-4-Piperidinamines that are Useful in the Treatment of COPD and Asthma CCR1, CCR4, CCR10 PPARD 127/4885MAPT 3981/4885PPARG 143/4885

“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.