SCHEMBL4088397

SCHEMBL4088397

CCOc1ccc2c(c1)c(C(=O)C(=O)Nc1ccncn1)c(C(F)(F)F)n2Cc1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.43
ALOX5AP P20292 6/20 0.41
ALOX5 P09917 4/20 0.41
PLA2G2A P14555 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
MAPT P10636 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL4380885 0.97 FAAH (0.45) FAAHALOX5APALOX5PLA2G2APTGS2
SCHEMBL4088424 0.93 FAAH (0.47) FAAHALOX5APALOX5PLA2G2APTGS1
SCHEMBL4083416 0.91 F2RL3 (0.35) FAAHALOX5APALOX5PLA2G2AMAPT
SCHEMBL4088689 0.90 FAAH (0.44) FAAHALOX5APALOX5PTGS1PTGS2
SCHEMBL2993129 0.90 FAAH (0.51) FAAHALOX5APALOX5PLA2G2AMAPT
SCHEMBL2995166 0.89 FAAH (0.46) FAAHALOX5APALOX5PLA2G2APTGS1
SCHEMBL4101976 0.89 FAAH (0.53) FAAHALOX5APALOX5PTGS1MAPT
SCHEMBL4562856 0.89 FAAH (0.53) FAAHALOX5APALOX5PTGS1MAPT
SCHEMBL4090379 0.88 FAAH (0.42) FAAHALOX5APALOX5MAPT
SCHEMBL4088383 0.87 FAAH (0.46) FAAHALOX5APALOX5CYP3A4CYP2C9

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
EP-2610244-A1 Indole compounds Ironwood Pharmaceuticals, Inc. (US) 2013-07-03 EP disclosed
US-20090118503-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. 2009-05-07 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-20090118503-A1 FAAH INHIBITORS FAAH, FAAH2, CNR2 FAAH 1/4885ALOX5AP 26/4885ALOX5 41/4885

“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.