SCHEMBL17556993

SCHEMBL17556993

CC(CCCCc1ccccc1)c1cccnc1OC(=O)Oc1ncccc1C(C)CCCCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.41
TRPA1 O75762 1/20 0.40
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
EPHX2 P34913 2/20 0.39
ATM Q13315 1/20 0.38
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
PPARG P37231 1/20 0.38

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
SCHEMBL17556996 0.93 FAAH (0.41) FAAHTRPA1KMT2AL3MBTL1CYP2D6
SCHEMBL17556994 0.93 FAAH (0.41) FAAHTRPA1KMT2AL3MBTL1CYP2D6
SCHEMBL15329486 0.84 FAAH (0.41) FAAHALOX5PPARG
SCHEMBL16056927 0.78 BID (0.44) FAAHKMT2A
SCHEMBL15329487 0.78 FAAH (0.40) FAAHPTGESALOX5PPARG
SCHEMBL16057367 0.77 BID (0.47) FAAH
SCHEMBL16057401 0.75 PTGER1 (0.46) FAAHKMT2AL3MBTL1
SCHEMBL14975188 0.74 NAAA (0.47) FAAHPTGESALOX5PPARG
SCHEMBL15329202 0.74 ALOX5 (0.39) FAAHKMT2AL3MBTL1ALOX5
SCHEMBL14975151 0.72 FAAH (0.40) FAAHPTGESALOX5PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828338-B2 Carbamate derivatives of lactam based N-acylethanolamine acid amidase (NAAA) inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-11-28 US disclosed
US-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-03-10 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-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS NAAA, FAAH, FAAH2 FAAH 2/4885TRPA1 1343/4885KMT2A 601/4885

“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.