SCHEMBL5453555

SCHEMBL5453555

CNC(=O)COC(=O)N1CCC(CCc2cccc(-c3ccccc3)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.66
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CHRM4 P08173 2/20 0.43
GRIN2B Q13224 4/20 0.42
BCHE P06276 1/20 0.42
MAOB P27338 1/20 0.42
MGLL Q99685 1/20 0.42
HTT P42858 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
PARP14 Q460N5 1/20 0.40

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
SCHEMBL5450845 0.94 FAAH (0.58) FAAHMEN1KMT2ACHRM4GRIN2B
SCHEMBL5454086 0.87 FAAH (0.77) FAAHMEN1KMT2ACHRM4GRIN2B
SCHEMBL5451896 0.85 FAAH (0.65) FAAHMEN1KMT2ACHRM4MAOB
SCHEMBL5453621 0.84 FAAH (0.70) FAAHMEN1KMT2ACHRM4GRIN2B
SCHEMBL2178066 0.83 FAAH (0.48) FAAHMEN1KMT2A
SCHEMBL2178285 0.82 FAAH (0.44) FAAHMEN1KMT2ANPC1RAB9A
SCHEMBL1532820 0.82 KDM4E (0.55) SMN1; SMN2
SCHEMBL5454085 0.82 FAAH (0.60) FAAHMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL2177149 0.82 SIGMAR1 (0.51) FAAHMGLL
Hydrochloric Acid SCHEMBL2178562 0.81 FAAH (0.43) FAAHMEN1KMT2ANPC1RAB9A

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 FAAH 1/4885MEN1 1621/4885KMT2A 1716/4885

“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.