SCHEMBL6129197

SCHEMBL6129197

CCCCCCCNC(=O)Oc1nc(-c2ccccc2OC)c[nH]1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.47
ADORA3 P0DMS8 1/20 0.43
ADORA1 P30542 1/20 0.43
FAAH O00519 1/20 0.43

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
SCHEMBL5252622 0.84 MGLL (0.50) MGLL
SCHEMBL2349053 0.71 CTSA (0.41) ADORA3ADORA1
SCHEMBL2349057 0.71 CTSA (0.41) ADORA3ADORA1
SCHEMBL9460406 0.71 FAAH (0.60) MGLLFAAH
SCHEMBL14736076 0.69 IDO1 (0.55) ADORA3ADORA1
SCHEMBL27564494 0.69 TLR8 (0.41) ADORA3ADORA1
SCHEMBL27564493 0.69 TLR8 (0.41) ADORA3ADORA1
SCHEMBL25277427 0.69 MGLL (0.64) MGLL
SCHEMBL30433811 0.69 MGLL (0.56) MGLL
SCHEMBL14736555 0.69 CDK4 (0.44) ADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038087-A1 Derivatives of heterocycles with 5 members, their preparation and their use as medicaments IPSEN PHARMA S.A.S. (FR) 2005-02-17 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-20050038087-A1 Derivatives of heterocycles with 5 members, their preparation and their use as medicaments OXER1, OPRL1, OPRK1 MGLL 3702/4885ADORA3 676/4885ADORA1 610/4885

“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.