SCHEMBL6133006

SCHEMBL6133006

COCCCCCCCOc1ccc(Br)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 2/20 0.51
DRD2 P14416 1/20 0.51
DRD3 P35462 1/20 0.51
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KDM4E B2RXH2 4/20 0.49
NOS1 P29475 2/20 0.49
RECQL P46063 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 2/20 0.49
LSS P48449 4/20 0.47
GAA P10253 1/20 0.46
NR5A1 Q13285 1/20 0.46
RAB9A P51151 1/20 0.45
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL6132842 1.00 DRD4 (0.51) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL4598755 0.98 DRD4 (0.53) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL7333293 0.94 DRD4 (0.47) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL7334037 0.94 DRD4 (0.47) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL7339801 0.94 DRD4 (0.47) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL7317588 0.94 DRD4 (0.47) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL4598588 0.94 DRD4 (0.53) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL20662545 0.93 KDM4E (0.49) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL7898603 0.89 ATM (0.58) DRD4DRD2DRD3ATML3MBTL1
SCHEMBL17465617 0.89 ATM (0.58) DRD4DRD2DRD3ATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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