SCHEMBL6132633

SCHEMBL6132633

BrCCCCCCCCOc1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NOS1 P29475 2/20 0.50
DRD4 P21917 2/20 0.49
DRD3 P35462 2/20 0.49
DRD2 P14416 1/20 0.49
LSS P48449 1/20 0.48
PRMT1 Q99873 3/20 0.47
F2 P00734 2/20 0.47
ST14 Q9Y5Y6 2/20 0.47
PLAU P00749 1/20 0.47
GAA P10253 1/20 0.47
PRMT5 O14744 1/20 0.47
SLC22A2 O15244 1/20 0.47
SLC22A1 O15245 1/20 0.47
TMPRSS2 O15393 1/20 0.47
PTP4A3 O75365 1/20 0.47
SLC22A3 O75751 1/20 0.47
F10 P00742 1/20 0.47
PLG P00747 1/20 0.47

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
SCHEMBL6753836 1.00 ATM (0.51) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL6132362 1.00 ATM (0.51) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL6132620 1.00 ATM (0.51) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL5841721 0.98 L3MBTL1 (0.53) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL4828609 0.94 KDM4E (0.48) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL7338768 0.94 KDM4E (0.48) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL7333008 0.94 KDM4E (0.48) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL7334762 0.94 KDM4E (0.48) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL10390074 0.92 ATM (0.46) ATML3MBTL1NOS1DRD4DRD3
SCHEMBL7147877 0.92 KDM4E (0.49) ATML3MBTL1NOS1DRD4DRD3

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
CN-102417587-A Electro-phosphorescence polymer containing (alkyl-substituted-)S,S- dioxo-dibenzothiophene unit and application thereof UNIV SOUTH CHINA TECH 2012-04-18 CN disclosed
US-6884868-B1 Cyclic hexapeptides having antibiotic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-04-26 US disclosed
EP-1173472-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-23 EP disclosed
WO-2000064927-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 WO disclosed