SCHEMBL8896643

SCHEMBL8896643

Cc1ccccc1C(OC(c1ccc(N2CCN(Cc3ccccc3)CC2)cc1)c1ccccc1C)c1ccc(N2CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 4/20 0.56
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SIGMAR1 Q99720 2/20 0.50
LMNA P02545 3/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 2/20 0.47
MAPT P10636 3/20 0.47
ALDH1A1 P00352 1/20 0.47
CHRNA7 P36544 1/20 0.46
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
ALOX15 P16050 1/20 0.45
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL8896634 0.86 DRD4 (0.51) DRD4MEN1KMT2ASIGMAR1LMNA
SCHEMBL15247183 0.78 DRD4 (0.71) DRD4SIGMAR1LMNAKDM4EMAPT
SCHEMBL12385909 0.76 DRD4 (0.77) DRD4SIGMAR1LMNAKDM4EPOLB
SCHEMBL4195949 0.75 SLC6A2 (0.51) CHRNA7DRD3
SCHEMBL11990246 0.75 DRD4 (0.64) DRD4MEN1KMT2ASIGMAR1LMNA
SCHEMBL6031812 0.74 DRD4 (1.00) DRD4SIGMAR1KDM4EALDH1A1CHRNA7
SCHEMBL11989515 0.74 DRD4 (0.62) DRD4SIGMAR1LMNAKDM4EPOLB
SCHEMBL5217502 0.73 MAPT (0.57) DRD4MEN1KMT2ASIGMAR1LMNA
SCHEMBL27619095 0.73 DRD4 (0.60) DRD4MEN1KMT2ASIGMAR1LMNA
SCHEMBL27619094 0.73 DRD4 (0.61) DRD4MEN1KMT2ASIGMAR1LMNA

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
US-5652242-A 3-METHYL-4-(4-(4-(4-PYRIDYL)PIPERAZIN-1-YL)PHENOXY)BURYIC ACID, AMIDE OR ESTER; INHIBITORS OF BINDING OF FIBRINOGEN TO GLYCOPROTEIN ZENECA LIMITED (GB) 1997-07-29 US disclosed