SCHEMBL8536746

SCHEMBL8536746

COc1ccc(Cl)c(OCCCCCCI)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.53
L3MBTL1 Q9Y468 7/20 0.53
TDP1 Q9NUW8 1/20 0.53
HPGD P15428 6/20 0.45
ALDH1A1 P00352 3/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
MAPK1 P28482 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
POLB P06746 1/20 0.45
ALOX12 P18054 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HTR2A P28223 4/20 0.40
SLC6A4 P31645 4/20 0.40
KCNH2 Q12809 3/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL8539012 0.88 MAPT (0.53) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL8902457 0.88 MAPT (0.53) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL8536556 0.88 MAPT (0.53) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL11444316 0.88 MAPT (0.53) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL8535069 0.88 MAPT (0.53) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL11433262 0.86 MAPT (0.54) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL11565117 0.81 MAPT (0.51) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL12978667 0.80 ALDH1A1 (0.54) MAPTL3MBTL1HPGDALDH1A1CYP2C9
SCHEMBL14968907 0.80 L3MBTL1 (0.50) MAPTL3MBTL1TDP1HPGDALDH1A1
SCHEMBL8903264 0.78 MAPT (0.60) MAPTL3MBTL1TDP1HPGDALDH1A1

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 5 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
US-5272167-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-12-21 US 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