SCHEMBL8077690

SCHEMBL8077690

CCCOc1ccccc1CCCCCBr

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.49
LTB4R2 Q9NPC1 1/20 0.49
MAPT P10636 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
PPARD Q03181 1/20 0.43
ADRB2 P07550 4/20 0.43
ADRB1 P08588 4/20 0.43
HPGD P15428 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL8070754 1.00 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8071192 1.00 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8062357 1.00 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8077723 1.00 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8076241 0.98 LTB4R (0.47) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8072240 0.94 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8076069 0.94 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8070968 0.94 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8076369 0.94 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1
SCHEMBL8076101 0.94 LTB4R (0.49) LTB4RLTB4R2MAPTL3MBTL1NPSR1

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-6063940-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-16 US disclosed
US-5637736-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-10 US disclosed
EP-0637580-A1 Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-08 EP disclosed