SCHEMBL2537578

SCHEMBL2537578

[CH2]CCCCC(C)OC(=O)NC

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
NAAA Q02083 2/20 0.38
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
ALDH1A1 P00352 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
EPHX1 P07099 1/20 0.32

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
SCHEMBL2538589 0.98 FAAH (0.41) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL2541164 0.94 CHRNB2 (0.37) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL2542749 0.86 CHRNB2 (0.39) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL11272584 0.81 FAAH (0.57) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL10639411 0.81 FAAH (0.57) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL10633033 0.81 FAAH (0.57) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL11095613 0.81 FAAH (0.57) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL25698859 0.80 ALDH1A1 (0.45) FAAHCNR1CNR2NAAAKDM4E
SCHEMBL2541541 0.79 CTSK (0.40) CHRNB2CHRNA4EPHX1
SCHEMBL2536193 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044070-B2 Heteroaryloxy nitrogenous saturated heterocyclic derivative MSD K.K. (JP) 2011-10-25 US disclosed
US-20100210637-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE MSD K.K. (JP) 2010-08-19 US disclosed
US-7595316-B2 Heteroaryloxy nitrogenous saturated heterocyclic derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-09-29 US disclosed
US-20060178375-A1 Heteroaryloxy nitrogenous saturated heterocyclic derivative MSD K.K. (JP) 2006-08-10 US disclosed
EP-1642898-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-04-05 EP 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-20060178375-A1 Heteroaryloxy nitrogenous saturated heterocyclic derivative HRH3, HRH4, HCRTR2 FAAH 163/4885CNR1 13/4885CNR2 11/4885
US-20100210637-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE HRH3, HRH4, HRH2 FAAH 203/4885CNR1 16/4885CNR2 13/4885

“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.