SCHEMBL1786965

SCHEMBL1786965

COc1ccc2c(c1)c(CN1CCC(NC(=O)c3cc(OC)c(C)c(OC)c3)CC1)cn2C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.52
SSTR5 P35346 3/20 0.50
SIGMAR1 Q99720 1/20 0.49
NQO2 P16083 1/20 0.48
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48
DRD4 P21917 1/20 0.47
POLB P06746 2/20 0.47
ACHE P22303 1/20 0.47
USP2 O75604 1/20 0.47

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
SCHEMBL1786793 0.91 MCHR1 (0.50) MCHR1SSTR5SIGMAR1DRD4POLB
SCHEMBL1790769 0.90 MCHR1 (0.49) MCHR1SSTR5SIGMAR1DRD4POLB
SCHEMBL1787956 0.90 MCHR1 (0.51) MCHR1SSTR5SIGMAR1DRD4POLB
SCHEMBL12614652 0.89 SSTR5 (0.58) MCHR1SSTR5POLBUSP2
SCHEMBL1790544 0.79 SSTR5 (0.57) MCHR1SSTR5DRD4POLBACHE
SCHEMBL1788399 0.77 MCHR1 (0.58) MCHR1SSTR5SIGMAR1DRD4ACHE
SCHEMBL1787892 0.77 SSTR5 (0.55) MCHR1SSTR5DRD4POLBACHE
SCHEMBL1787380 0.77 SSTR5 (0.55) MCHR1SSTR5DRD4ACHE
SCHEMBL1786527 0.76 SSTR5 (0.54) MCHR1SSTR5DRD4POLBACHE
SCHEMBL1789399 0.76 MCHR1 (0.76) MCHR1SIGMAR1DRD4ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110124674-A1 5/5-OR 5/6-MEMBERED CONDENSED RING CYCLOALKYLAMINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2011-05-26 US disclosed
EP-2319841-A1 (5-MEMBERED)-(5-MEMBERED) OR (5-MEMBERED)-(6-MEMBERED) FUSED RING CYCLOALKYLAMINE DERIVATIVE MSD K.K. (JP) 2011-05-11 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-20110124674-A1 5/5-OR 5/6-MEMBERED CONDENSED RING CYCLOALKYLAMINE DERIVATIVE MCHR1, MC5R, MCHR2 MCHR1 1/4885SSTR5 22/4885SIGMAR1 155/4885

“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.