SCHEMBL4183181

SCHEMBL4183181

O=C(NC1CCCCC1)Oc1cccc(C(=O)O)c1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.71
ALDH1A1 P00352 1/20 0.71
RAB9A P51151 1/20 0.71
TRPA1 O75762 1/20 0.67
EPHX2 P34913 1/20 0.67
FAAH2 Q6GMR7 1/20 0.67
MGLL Q99685 1/20 0.67
HDAC6 Q9UBN7 1/20 0.67
EPHX1 P07099 1/20 0.63

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
SCHEMBL4965649 0.88 FAAH (0.66) FAAHALDH1A1RAB9ATRPA1EPHX2
SCHEMBL4750537 0.88 FAAH (0.86) FAAHALDH1A1RAB9ATRPA1EPHX2
SCHEMBL4751725 0.86 FAAH (0.65) FAAHALDH1A1RAB9ATRPA1EPHX2
SCHEMBL4748396 0.85 FAAH (0.62) FAAHALDH1A1RAB9ATRPA1EPHX2
SCHEMBL14288607 0.85 FAAH (0.62) FAAHALDH1A1RAB9ATRPA1EPHX2
SCHEMBL14470485 0.84 FAAH (0.62) FAAHALDH1A1RAB9ATRPA1EPHX2
SCHEMBL21618461 0.84 ALDH1A1 (1.00) FAAHALDH1A1RAB9AEPHX1
SCHEMBL1532563 0.84 ALDH1A1 (1.00) FAAHALDH1A1RAB9AEPHX1
SCHEMBL8393776 0.84 ALDH1A1 (1.00) FAAHALDH1A1RAB9AEPHX1
SCHEMBL530169 0.83 FAAH (1.00) FAAHALDH1A1RAB9ATRPA1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2023930-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. Organon (NL) 2009-02-18 EP claimed
WO-2008020866-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. ORGANON 2008-02-21 WO claimed
US-20070155707-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE KADMUS PHARMACEUTICALS, INC. (US) 2007-07-05 US claimed
EP-2023930-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. Organon (NL) 2009-02-18 EP disclosed
US-20080089845-A1 METHODS FOR DETERMINING EFFECTIVE DOSES OF FATTY ACID AMIDE HYDROLASE INHIBITORS IN VIVO N.V. ORGANON (NL) 2008-04-17 US disclosed
US-20080089845-A1 METHODS FOR DETERMINING EFFECTIVE DOSES OF FATTY ACID AMIDE HYDROLASE INHIBITORS IN VIVO N.V. ORGANON (NL) 2008-04-17 US disclosed
WO-2008030752-A2 METHODS FOR DETERMINING EFFECTIVE DOSES OF FATTY ACID AMIDE HYDROLASE INHIBITORS IN VIVO N.V. ORGANON (NL) 2008-03-13 WO disclosed
WO-2008020866-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. ORGANON 2008-02-21 WO disclosed
WO-2008020866-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. ORGANON 2008-02-21 WO disclosed
US-20070155707-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE KADMUS PHARMACEUTICALS, INC. (US) 2007-07-05 US disclosed
US-20070155707-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE KADMUS PHARMACEUTICALS, INC. (US) 2007-07-05 US disclosed
US-20070155707-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE KADMUS PHARMACEUTICALS, INC. (US) 2007-07-05 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 (2 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-20080089845-A1 METHODS FOR DETERMINING EFFECTIVE DOSES OF FATTY ACID AMIDE HYDROLASE INHIBITORS IN VIVO FAAH, FAAH2, FADS1 FAAH 1/4885ALDH1A1 253/4885RAB9A 2421/4885
US-20070155707-A1 IONIZABLE INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, NAAA FAAH 1/4885ALDH1A1 366/4885RAB9A 2583/4885

“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.