SCHEMBL8388708

SCHEMBL8388708

Oc1cc(OCC(O)COCC(O)COc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c(O)c2)ccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.43
ADORA3 P0DMS8 1/20 0.43
TSHR P16473 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
MAPT P10636 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
MAPK10 P53779 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 2/20 0.39
HSP90AA1 P07900 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ADRB2 P07550 2/20 0.39
ADRB1 P08588 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
SCHEMBL8216433 0.92 LMNA (0.42) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL14274500 0.91 CHRNA7 (0.44) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL14202624 0.90 ADRB2 (0.42) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL14793445 0.90 FGFR1 (0.46) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL8383224 0.90 PLA2G4B (0.42) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL8517433 0.90 PLA2G4B (0.42) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL12755352 0.89 LMNA (0.45) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL7896079 0.88 NR2E1 (0.43) ALOX15ADORA3TSHRADORA2AADORA2B
SCHEMBL6334661 0.88 PLA2G4B (0.41) MAPTLMNAGAAMAPK10CNR1
SCHEMBL7887570 0.87 MAPT (0.43) MAPTNPSR1LMNAGAAMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912531-A1 POLYOXYALKENE SUBSTITUTED AND BRIDGED TRIAZINE, BENZOTRIAZOLE AND BENZOPHENONE DERIVATIVES AS UV ABSORBERS Ciba SC Holding AG (CH) 1999-05-06 EP disclosed
WO-1998003489-A1 POLYOXYALKENE SUBSTITUTED AND BRIDGED TRIAZINE, BENZOTRIAZOLE AND BENZOPHENONE DERIVATIVES AS UV ABSORBERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1998-01-29 WO disclosed