SCHEMBL9257214

SCHEMBL9257214

Clc1ccc(C(OC2CC[N]CC2)c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.59
MEN1 O00255 2/20 0.59
MAPT P10636 2/20 0.59
KMT2A Q03164 2/20 0.59
CYP2D6 P10635 2/20 0.59
TP53 P04637 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
TSHR P16473 1/20 0.59
NFKB1 P19838 1/20 0.59
THPO P40225 1/20 0.59
DRD2 P14416 1/20 0.59
DRD4 P21917 1/20 0.59
HTT P42858 1/20 0.59
GMNN O75496 1/20 0.58
LMNA P02545 1/20 0.58
PMP22 Q01453 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
SLC6A3 Q01959 2/20 0.50

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
SCHEMBL2092340 0.94 DRD3 (0.55) DRD3MEN1MAPTKMT2ACYP2D6
SCHEMBL8643817 0.90 DRD3 (0.59) DRD3MEN1MAPTKMT2ACYP2D6
SCHEMBL9250346 0.84 SLC6A2 (0.51) DRD3CYP2D6CYP1A2TSHRDRD2
SCHEMBL9256723 0.84 DRD3 (0.54) DRD3MEN1MAPTKMT2ACYP2D6
SCHEMBL9257208 0.82 IDO1 (0.51) DRD3MEN1MAPTKMT2ACYP2D6
SCHEMBL9256629 0.82 DRD3 (0.51) DRD3MEN1MAPTKMT2ACYP2D6
SCHEMBL8537416 0.81 DRD3 (0.59) DRD3MEN1MAPTKMT2ACYP2D6
SCHEMBL9253963 0.77 SLC6A3 (0.55) DRD3CYP2D6CYP1A2TSHRDRD2
SCHEMBL9250050 0.77 SLC6A3 (0.44) DRD3CYP2D6CYP1A2TSHRDRD2
SCHEMBL9256722 0.76 CYP2D6 (0.48) DRD3MEN1MAPTKMT2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5470851-A Antihistamine, anticoagulants SANKYO COMPANY, LIMITED (JP) 1995-11-28 US claimed
EP-0463873-A1 Thiazolidinecarboxylic acid amide derivatives having anti-allergic activity, their preparation and their use Sankyo Company Limited (JP) 1992-01-02 EP claimed
US-5470851-A Antihistamine, anticoagulants SANKYO COMPANY, LIMITED (JP) 1995-11-28 US disclosed
EP-0463873-A1 Thiazolidinecarboxylic acid amide derivatives having anti-allergic activity, their preparation and their use Sankyo Company Limited (JP) 1992-01-02 EP disclosed