SCHEMBL5449588

SCHEMBL5449588

CNC(=O)COC(=O)N1CCC(c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.51
FAAH O00519 1/20 0.49
CHRM4 P08173 1/20 0.48
CCR2 P41597 2/20 0.47
HTT P42858 3/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
USP2 O75604 1/20 0.45
USP5 P45974 1/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
ALDH1A1 P00352 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA2B P29275 1/20 0.44
ADORA1 P30542 1/20 0.44
POLB P06746 1/20 0.43
HTR2C P28335 2/20 0.43
HCRTR2 O43614 1/20 0.43
RAB9A P51151 1/20 0.43
MAPT P10636 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
SCHEMBL5447949 0.86 DRD2 (0.51) DRD2CHRM4CCR2HTTLMNA
SCHEMBL5460480 0.83 FAAH (0.55) FAAHCHRM4ALDH1A1POLBRAB9A
SCHEMBL5451896 0.82 FAAH (0.65) FAAHCHRM4HTTLMNAMAPK1
SCHEMBL5451889 0.81 FAAH (0.57) FAAHCHRM4HTTLMNAMAPK1
SCHEMBL5234744 0.81 ALDH1A1 (0.67) HTTLMNAMAPK1USP2ALDH1A1
SCHEMBL1581482 0.76 DRD2 (0.58) DRD2CHRM4CCR2LMNAUSP5
SCHEMBL594530 0.76 ALDH1A1 (0.53) HTTLMNAMAPK1USP2ALDH1A1
SCHEMBL1761033 0.75 DRD2 (0.56) DRD2CHRM4CCR2USP5ESR1
SCHEMBL5450185 0.75 FAAH (0.77) FAAHALDH1A1SMN1; SMN2
SCHEMBL5444491 0.75 TRPC3 (0.47) FAAHHTTLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021405-A1 ARYL- AND HETEROARYLPIPERIDINECARBOXYLATE-DERIVATIVES METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2007-01-25 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-20070021405-A1 ARYL- AND HETEROARYLPIPERIDINECARBOXYLATE-DERIVATIVES METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, HRH2 DRD2 2170/4885FAAH 1/4885CHRM4 1457/4885

“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.