SCHEMBL9959543

SCHEMBL9959543

COc1cc(NC(=O)C(=O)c2c(C)n(Cc3ccc(Cl)cc3)c3cccc(OC)c23)ccn1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.72
PLA2G2A P14555 9/20 0.52
MAPT P10636 1/20 0.46
PLA2G1B P04054 2/20 0.44
PLA2G10 O15496 1/20 0.44
PLA2G5 P39877 1/20 0.44
PLA2G2E Q9NZK7 1/20 0.44
CNR1 P21554 1/20 0.42

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
SCHEMBL9959625 0.92 FAAH (0.60) FAAHPLA2G2AMAPTPLA2G1BPLA2G10
SCHEMBL9958677 0.90 FAAH (0.74) FAAHPLA2G2AMAPTPLA2G1BPLA2G10
SCHEMBL9952287 0.89 FAAH (0.73) FAAHPLA2G2AMAPTPLA2G1BPLA2G10
SCHEMBL9952400 0.88 FAAH (0.72) FAAHPLA2G2AMAPTCNR1
SCHEMBL9952543 0.88 FAAH (0.82) FAAHPLA2G2AMAPTCNR1
SCHEMBL2159570 0.87 FAAH (0.84) FAAHPLA2G2AMAPTCNR1
SCHEMBL9959484 0.86 FAAH (0.80) FAAHPLA2G2AMAPTCNR1
SCHEMBL9953109 0.86 FAAH (0.72) FAAHMAPTCNR1
SCHEMBL9958589 0.86 FAAH (0.74) FAAHMAPTCNR1
SCHEMBL2169687 0.86 FAAH (0.91) FAAHPLA2G2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9657012-B2 FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2017-05-23 US disclosed
US-9657012-B2 FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2017-05-23 US disclosed
US-9657012-B2 FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2017-05-23 US disclosed
EP-2655356-B1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS INC (US) 2016-08-03 EP disclosed
EP-2655356-B1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS INC (US) 2016-08-03 EP disclosed
US-20150175599-A1 FAAH Inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2015-06-25 US disclosed
WO-2014004676-A1 USE OF FAAH INHIBITORS AS NEUROPROTECTIVE AGENTS IN THE CNS IRONWOOD PHARMACEUTICALS, INC. (US) 2014-01-03 WO disclosed
EP-2655356-A1 FAAH INHIBITORS Ironwood Pharmaceuticals, Inc. (US) 2013-10-30 EP disclosed
WO-2012088469-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 WO disclosed
WO-2012088469-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 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-20150175599-A1 FAAH Inhibitors FAAH, FAAH2, ASAH1 FAAH 1/4885PLA2G2A 63/4885MAPT 3363/4885

“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.