SCHEMBL2236620

SCHEMBL2236620

Cc1cccc2[nH]c(C(=O)N3CCN(C(=O)Oc4cccnc4)CC3)nc12

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 4/20 0.63
DRD2 P14416 9/20 0.51
DRD3 P35462 9/20 0.51
PARP1 P09874 5/20 0.49
PDE10A Q9Y233 2/20 0.46
PARP2 Q9UGN5 1/20 0.41

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
SCHEMBL12271820 0.89 HRH4 (0.49) HRH4DRD2DRD3PARP1
SCHEMBL12271953 0.88 HRH4 (0.48) HRH4DRD2DRD3PARP1
SCHEMBL12271795 0.88 DRD2 (0.51) HRH4DRD2DRD3PARP1PDE10A
SCHEMBL12271903 0.88 PDE10A (0.54) HRH4DRD2DRD3PARP1PDE10A
SCHEMBL12271606 0.88 HRH4 (0.63) HRH4DRD2DRD3PARP1PDE10A
SCHEMBL12271811 0.87 HRH4 (0.46) HRH4DRD2DRD3PARP1PARP2
SCHEMBL12271814 0.87 HRH4 (0.50) HRH4DRD2DRD3PARP1
SCHEMBL12272026 0.86 HRH4 (0.48) HRH4DRD2DRD3PARP1PDE10A
SCHEMBL12271931 0.85 HRH4 (0.63) HRH4DRD2DRD3PARP1
SCHEMBL2238492 0.84 DRD2 (0.55) HRH4DRD2DRD3

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-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-09-01 US claimed
US-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-09-01 US disclosed
US-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-09-01 US disclosed
US-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-09-01 US disclosed
EP-2351749-A1 CARBAMATE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-08-03 EP disclosed
EP-2351749-A1 CARBAMATE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-08-03 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 (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-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF FAAH, FAAH2, TRPV1 HRH4 46/4885DRD2 3283/4885DRD3 2916/4885

“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.