SCHEMBL3586725

SCHEMBL3586725

COc1ccc(CCCN2CCC(NC(=O)O)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.58
SIGMAR1 Q99720 3/20 0.57
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
DRD4 P21917 2/20 0.54
KCNA3 P22001 1/20 0.54
C5AR1 P21730 1/20 0.53
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
POLB P06746 1/20 0.52
CXCR3 P49682 1/20 0.52
KMT2A Q03164 1/20 0.51
KDM1A O60341 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
MCHR1 Q99705 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51

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
SCHEMBL3586870 0.84 SIGMAR1 (0.55) SIGMAR1DRD4C5AR1CXCR3HRH3
SCHEMBL3604725 0.83 LTA4H (0.60) DRD2SIGMAR1KCNA3C5AR1KDM1A
SCHEMBL9871216 0.82 LTA4H (0.60) SIGMAR1ALDH1A1HRH3
SCHEMBL3946392 0.81 CHRM4 (0.62) DRD2SIGMAR1KCNA3KDM1AHDAC6
SCHEMBL9872534 0.80 DRD4 (0.64) SIGMAR1DRD4ALDH1A1POLBKMT2A
SCHEMBL3604727 0.80 C5AR1 (0.60) DRD2SIGMAR1KCNA3C5AR1KMT2A
SCHEMBL4305546 0.79 L3MBTL1 (0.64) SIGMAR1CYP3A4CYP2C19DRD4CXCR3
SCHEMBL8971246 0.79 DRD2 (0.59) DRD2SIGMAR1KCNA3C5AR1KDM1A
SCHEMBL16444219 0.79 HRH2 (0.52) DRD2SIGMAR1CYP1A2CYP3A4CYP2D6
SCHEMBL5709471 0.79 DRD2 (0.56) DRD2SIGMAR1KCNA3C5AR1KMT2A

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-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP claimed
US-20100279998-A1 PIPERIDINYLALKYLCARBAMATE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THE THERAPEUTIC USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2010-11-04 US disclosed
EP-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP 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-20100279998-A1 PIPERIDINYLALKYLCARBAMATE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THE THERAPEUTIC USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR2 DRD2 2044/4885SIGMAR1 2487/4885CYP1A2 728/4885

“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.