SCHEMBL7305951

SCHEMBL7305951

CC1CN(C(=O)CC2CC3CCC(C2)N3C)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.55
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
CHRM3 P20309 10/20 0.44
CHRM2 P08172 7/20 0.44
CHRM1 P11229 7/20 0.44
AKT1 P31749 2/20 0.41
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39

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
SCHEMBL7266681 0.79 NOTUM (0.53) NOTUM
Hydrochloric Acid SCHEMBL7439063 0.78 NOTUM (0.52) NOTUM
SCHEMBL7304610 0.76 NOTUM (0.52) NOTUMCHRM3CHRM2CHRM1
SCHEMBL7550236 0.74 NOTUM (0.69) NOTUMDRD2DRD4AKT1PIK3CD
SCHEMBL14294095 0.72 NOTUM (1.00) NOTUMDRD2DRD4AKT1PIK3CD
SCHEMBL27852096 0.72 NOTUM (0.75) NOTUMDRD2DRD4AKT1PIK3CD
Fumaric Acid SCHEMBL7304917 0.70 NOTUM (0.47) NOTUMCHRM3CHRM2CHRM1
Maleic Acid SCHEMBL7304911 0.70 NOTUM (0.47) NOTUMCHRM3CHRM2CHRM1
SCHEMBL9602684 0.70 HTR6 (0.46) NOTUM
SCHEMBL4917429 0.70 HTR3E (0.56) CHRM3CHRM2CHRM1

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-0403882-A2 Indole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-12-27 EP disclosed