SCHEMBL4229650

SCHEMBL4229650

CC(C)N1CCC(O)(c2ccc(C3=NC(C)(C)CO3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.43
OPRL1 P41146 8/20 0.40
OPRM1 P35372 7/20 0.40
OPRD1 P41143 7/20 0.40
OPRK1 P41145 7/20 0.40
CYP2D6 P10635 2/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL4229239 0.84 HRH3 (0.44) HRH3OPRL1OPRM1OPRD1OPRK1
SCHEMBL4238390 0.79 DRD2 (0.46) HRH3CYP2D6KDM4ELMNAMAPT
SCHEMBL4233587 0.78 OPRL1 (0.59) OPRL1KDM4E
SCHEMBL3295263 0.77 HRH3 (0.40) HRH3CYP2D6KDM4ELMNAMAPT
SCHEMBL471858 0.74 KDM4E (0.60) HRH3CYP2D6KDM4ELMNAMAPT
SCHEMBL25453172 0.72 OPRL1 (0.65) OPRL1OPRM1OPRD1OPRK1CYP2D6
SCHEMBL24422204 0.72 CYP2D6 (0.58) OPRL1OPRM1OPRD1OPRK1CYP2D6
SCHEMBL10057646 0.70 OPRM1 (0.63) OPRL1OPRM1OPRD1OPRK1CYP2D6
SCHEMBL23901648 0.70 OPRL1 (0.63) OPRL1OPRM1OPRD1OPRK1CYP2D6
SCHEMBL5962422 0.70 OPRM1 (0.63) OPRL1OPRM1OPRD1OPRK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R HRH3 210/4885OPRL1 19/4885OPRM1 179/4885

“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.