SCHEMBL3248230

SCHEMBL3248230

C=CCN1CCC[C@@H]2C(=O)N3c4ccccc4C[C@@H]3C21

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 12/20 0.41
DRD2 P14416 5/20 0.40
PRCP P42785 2/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL3242333 1.00 HTR1A (0.41) HTR1ADRD2PRCPSIGMAR1
SCHEMBL3239203 1.00 HTR1A (0.41) HTR1ADRD2PRCPSIGMAR1
SCHEMBL3236804 1.00 HTR1A (0.41) HTR1ADRD2PRCPSIGMAR1
SCHEMBL3242790 0.82 HRH3 (0.38) HTR1ASIGMAR1
SCHEMBL3239192 0.82 NOTUM (0.36)
SCHEMBL3246223 0.81 MEN1 (0.39)
SCHEMBL3243594 0.78 NOTUM (0.40) DRD2
SCHEMBL3243592 0.78 NOTUM (0.40) DRD2
SCHEMBL3236813 0.78 NOTUM (0.40) DRD2
SCHEMBL3244851 0.68 HTR1A (0.40) HTR1ADRD2

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
EP-2102204-B1 NEW AMINOPYRROLO[1,2- A]INDOLE ET AMINOPYRIDAZINO[1,6-A]INDOLE DERIVATIVES, METHOD FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME SERVIER LAB (FR) 2010-05-05 EP claimed