SCHEMBL3588640

SCHEMBL3588640

CN1CCN(S(=O)(=O)CCN2CC(c3cccc(Oc4cccnn4)c3)N(c3ccc(Cl)cc3)C2=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
FAAH O00519 2/20 0.32
P2RX3 P56373 6/20 0.31
MDM2 Q00987 1/20 0.31
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
DRD2 P14416 1/20 0.30
DRD3 P35462 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL3588637 1.00 L3MBTL1 (0.33) L3MBTL1FAAHP2RX3MDM2LMNA
SCHEMBL3593727 0.94 FAAH (0.33) FAAHP2RX3LMNADRD2DRD3
SCHEMBL3592132 0.94 FAAH (0.33) FAAHP2RX3LMNADRD2DRD3
SCHEMBL3592129 0.94 FAAH (0.33) FAAHP2RX3LMNADRD2DRD3
SCHEMBL3593731 0.94 FAAH (0.33) FAAHP2RX3LMNADRD2DRD3
SCHEMBL3585637 0.92 ALDH1A1 (0.33) L3MBTL1FAAH
SCHEMBL3585633 0.92 ALDH1A1 (0.33) L3MBTL1FAAH
SCHEMBL3593408 0.89 P2RX3 (0.33) FAAHP2RX3DRD2DRD3KCNH2
SCHEMBL3597619 0.88 P2RX3 (0.33) FAAHP2RX3
SCHEMBL3597624 0.88 P2RX3 (0.33) FAAHP2RX3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2013-08-15 US claimed
US-8431607-B2 Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2013-04-30 US claimed
US-20100234365-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2010-09-16 US claimed
US-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2013-08-15 US disclosed
US-8431607-B2 Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2013-04-30 US disclosed
US-20100234365-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2010-09-16 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-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH L3MBTL1 4596/4885FAAH 3/4885P2RX3 77/4885
US-20100234365-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH L3MBTL1 4596/4885FAAH 3/4885P2RX3 77/4885

“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.