SCHEMBL8856567

SCHEMBL8856567

c1c2c(cc3c1NCC3)OOC2

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KDM4E B2RXH2 1/20 0.34
AR P10275 2/20 0.32

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
SCHEMBL4496862 0.77 DRD2 (0.56) DRD2DRD4ALDH1A1MAPTKDM4E
SCHEMBL9739248 0.76 KDM4E (0.59) KDM4E
SCHEMBL5568453 0.71 KDM4E (0.58) DRD2DRD4ALDH1A1MAPTKDM4E
SCHEMBL6582387 0.71 DRD2 (0.50) DRD2DRD4ALDH1A1MAPTKDM4E
SCHEMBL4504545 0.67 DRD2 (0.47) DRD2DRD4ALDH1A1MAPTKDM4E
SCHEMBL8809053 0.67 DRD2 (0.36) DRD2DRD4ALDH1A1MAPTKDM4E
SCHEMBL13072273 0.67 ALDH1A1 (0.40) DRD2DRD4ALDH1A1MAPTKDM4E
SCHEMBL22506925 0.64 DRD2 (0.41) DRD2DRD4ALDH1A1MAPTKDM4E
SCHEMBL7501327 0.64 DRD2 (0.40) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL8261456 0.63 DRD2 (0.47) DRD2DRD4ALDH1A1MAPTKDM4E

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
EP-0575605-B1 MINERAL OR ORGANIC PARTICLE BASED PRODUCT COMPRISING AN INDOLINE PRODUCT OREAL (FR) 1996-11-27 EP claimed
US-5643672-A Cosmetic composition containing solid particles coated with an amphoteric polymer L'OREAL (FR) 1997-07-01 US disclosed