SCHEMBL9755019

SCHEMBL9755019

c1ccc(C(c2ccccc2)(c2ccccc2)C2NCCO2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.46
ADRA1A P35348 1/20 0.46
HTR2B P41595 1/20 0.46
SLC6A3 Q01959 1/20 0.46
CYP2D6 P10635 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
CYP1A2 P05177 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
HRH1 P35367 1/20 0.39
SCN1A P35498 1/20 0.39
KMT2A Q03164 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN3A Q9NY46 1/20 0.39
TACR1 P25103 7/20 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
SCHEMBL27461070 0.72 SLC6A2 (0.60) SLC6A2ADRA1AHTR2BSLC6A3CYP2D6
SCHEMBL11487302 0.69
SCHEMBL30825821 0.67 TSHR (0.42) SLC6A2CYP2D6KDM4ENPC1CYP1A2
SCHEMBL30825836 0.67 TSHR (0.42) SLC6A2CYP2D6KDM4ENPC1CYP1A2
SCHEMBL2257666 0.67 SLC6A2 (0.58) SLC6A2ADRA1AHTR2BSLC6A3CYP2D6
SCHEMBL460150 0.67 SLC6A2 (0.58) SLC6A2ADRA1AHTR2BSLC6A3CYP2D6
SCHEMBL20289098 0.66
SCHEMBL10808421 0.64
SCHEMBL15187684 0.64
SCHEMBL11883794 0.64

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
WO-1991007107-A1 OXAZOLIDINEDIONE HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1991-05-30 WO disclosed
EP-0428312-A2 Oxazolidinedione hypoglycemic agents PFIZER INC. (US) 1991-05-22 EP disclosed