SCHEMBL8536866

SCHEMBL8536866

COc1ccc(OCCCBr)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.51
L3MBTL1 Q9Y468 6/20 0.51
TDP1 Q9NUW8 2/20 0.51
S1PR4 O95977 1/20 0.50
HPGD P15428 6/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
CYP2C9 P11712 3/20 0.47
CYP2C19 P33261 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
MRGPRX4 Q96LA9 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 2/20 0.44
USP2 O75604 1/20 0.44
POLB P06746 1/20 0.44
ALOX12 P18054 1/20 0.44

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
SCHEMBL11034225 0.95 MAPT (0.54) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL8536913 0.94 MAPT (0.53) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL8537569 0.94 MAPT (0.53) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL11031521 0.94 MAPT (0.53) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL11435814 0.94 MAPT (0.53) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL11033897 0.94 MAPT (0.53) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL2004375 0.92 S1PR4 (0.51) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL8903264 0.88 MAPT (0.60) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL9217899 0.86 MAPT (0.54) MAPTL3MBTL1TDP1S1PR4HPGD
SCHEMBL8358492 0.85 MAPT (0.53) MAPTL3MBTL1TDP1S1PR4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750532-A TETRAHYDROPYRIMIDINE-2,4-DIONE DERIVATIVES, VIRICIDES, ANTIINFLAMMATORY AGENTS, PAF INHIBITORS SCHERING CORPORATION (US) 1998-05-12 US disclosed
US-5459144-A Enterovirus and rhinovirus antiviral, antiinflammatory and antagonist of platelet activating factor SCHERING CORPORATION (US) 1995-10-17 US disclosed
EP-0274867-B1 Pharmaceutically active compounds SCHERING CORP (US) 1994-04-13 EP disclosed
US-5272167-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-12-21 US disclosed
EP-0560407-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-09-15 EP disclosed
WO-1991000858-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS SCHERING CORPORATION (US) 1991-01-24 WO disclosed
EP-0407217-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1991-01-09 EP disclosed
US-4851423-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1989-07-25 US disclosed
EP-0274867-A2 Pharmaceutically active compounds SCHERING CORPORATION (US) 1988-07-20 EP disclosed
US-4171376-A Aryloxyalkyl keto-esters STERLING DRUG INC. (US) 1979-10-16 US disclosed