SCHEMBL1146829

SCHEMBL1146829

CCCc1ccc(NC(=O)C2(N)CCN(S(=O)(=O)c3ccccc3Cl)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.51
FAAH O00519 10/20 0.49
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
ATAD2 Q6PL18 1/20 0.41
CCR1 P32246 1/20 0.41
GRM4 Q14833 1/20 0.41

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
SCHEMBL1147275 0.94 EPHX2 (0.49) EPHX2FAAHMAPT
SCHEMBL1147263 0.92 EPHX2 (0.53) EPHX2FAAHMAPTATAD2
SCHEMBL1146756 0.87 FAAH (0.63) EPHX2FAAHMAPTCCR1
SCHEMBL15387630 0.86 EPHX2 (0.48) EPHX2FAAHMAPTRAB9AATAD2
SCHEMBL1147240 0.85 FAAH (0.51) EPHX2FAAHMAPTRAB9A
SCHEMBL1147222 0.85 FAAH (0.64) EPHX2FAAHMAPTCCR1
Hydrochloric Acid SCHEMBL1147225 0.84 FAAH (0.50) EPHX2FAAHMAPTRAB9A
SCHEMBL1147198 0.84 FAAH (0.51) EPHX2FAAHMAPTCCR1
SCHEMBL1147426 0.84 MAPT (0.46) EPHX2FAAHMAPTATAD2
SCHEMBL1147296 0.82 FAAH (0.48) EPHX2FAAHMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US claimed
WO-2011012602-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. HOFFMANN-LA ROCHE AG (CH) 2011-02-03 WO claimed
US-8399676-B2 Piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-8399676-B2 Piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
WO-2011012602-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. HOFFMANN-LA ROCHE AG (CH) 2011-02-03 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-20110028515-A1 NEW PIPERIDINE DERIVATIVES ADRA1D, ADORA1, H1-0 EPHX2 3415/4885FAAH 2059/4885MAPT 2319/4885

“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.