SCHEMBL9958563

SCHEMBL9958563

COc1cc(NC(=O)C(=O)c2c(C)n(Cc3ccc(Cl)cn3)c3cc(C)c(OC)cc23)ccn1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.65
CNR1 P21554 1/20 0.36
P2RX3 P56373 7/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
NTRK1 P04629 2/20 0.34
PDGFRA P16234 1/20 0.33
KDR P35968 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
MET P08581 1/20 0.33

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
SCHEMBL9953596 0.94 FAAH (0.65) FAAHCNR1P2RX3SCN10ANTRK1
SCHEMBL9952749 0.92 FAAH (0.64) FAAHCNR1P2RX3SCN10ANTRK1
SCHEMBL9953502 0.92 FAAH (0.65) FAAHCNR1P2RX3SCN10ANTRK1
SCHEMBL9958621 0.92 FAAH (0.67) FAAHCNR1P2RX3SCN10ANTRK1
SCHEMBL9958836 0.91 FAAH (0.57) FAAHSCN10APDGFRAKDR
SCHEMBL9959081 0.91 FAAH (0.65) FAAHCNR1P2RX3SCN10ANTRK1
SCHEMBL9953124 0.90 FAAH (0.80) FAAHCNR1P2RX3SCN10AMAPT
SCHEMBL9959645 0.90 FAAH (0.74) FAAHCNR1P2RX3SCN10AMAPT
SCHEMBL9959493 0.90 FAAH (0.81) FAAHCNR1P2RX3SCN10AMAPT
SCHEMBL9958758 0.88 FAAH (0.71) FAAHP2RX3MAPTTSHR

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 1/4885CNR1 22/4885P2RX3 508/4885

“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.