SCHEMBL4339035

SCHEMBL4339035

[O]c1cccc(O)c1Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.43
NR1H2 P55055 1/20 0.43
BAX Q07812 1/20 0.43
TSHR P16473 1/20 0.42
GAPDH P04406 1/20 0.41
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PNLIP P16233 1/20 0.40
AKR1C3 P42330 1/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
TTR P02766 2/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL1834612 0.85 LTA4H (0.52) LTA4HNR1H2BAXTSHRGAPDH
SCHEMBL10931576 0.78 LTA4H (0.55) LTA4HNR1H2BAXTSHRHPGD
SCHEMBL2091702 0.78 KMT2A (0.47) LTA4HTSHRHPGDKDM4EGLA
SCHEMBL982183 0.78 ALDH1A1 (0.47) LTA4HNR1H2BAXTSHRHPGD
Benzoic Acid SCHEMBL27449816 0.77 AKR1C3 (0.59) TSHRAKR1C3TTRKDM4EPARP10
SCHEMBL1270521 0.77 ALDH1A1 (0.55) HPGDALOX15HSD17B10PNLIPAKR1C3
SCHEMBL9481585 0.76 HTR1A (0.47) LTA4HNR1H2BAXTSHRGAPDH
SCHEMBL1532087 0.76 ALDH1A1 (0.48) LTA4HNR1H2BAXTSHRGAPDH
SCHEMBL28455965 0.76 LTA4H (0.43) LTA4HNR1H2BAXTSHRGAPDH
SCHEMBL1365263 0.76 TSHR (0.48) LTA4HNR1H2BAXTSHRGAPDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009048117-A1 EPOXY COMPOUND COMPOSITION FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2009-04-16 WO disclosed
EP-1063252-B1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KK (JP) 2005-06-08 EP disclosed
US-6632891-B1 Obtained by an ester exchange reaction between the flame retardant phosphazene and the polycarbonate or polyester resin OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2003-10-14 US disclosed
EP-1063252-A1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2000-12-27 EP disclosed