SCHEMBL28754128

SCHEMBL28754128

COP(Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
IDO1 P14902 1/20 0.40
AGXT P21549 1/20 0.39
ALDH1A1 P00352 4/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
MAOB P27338 1/20 0.38
MAPK1 P28482 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALOX5 P09917 1/20 0.36
LTA4H P09960 1/20 0.35
TP53 P04637 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
PTGS1 P23219 1/20 0.34
SLC6A2 P23975 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL383496 0.77 TSHR (0.48) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL9637850 0.77 TSHR (0.48) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL9052472 0.77 TSHR (0.48) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL20710812 0.76 KMT2A (0.41) TSHRALDH1A1MAOBMAPK1LTA4H
SCHEMBL673603 0.73 TSHR (0.44) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL10807891 0.73 TSHR (0.44) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL9407989 0.73 MAOB (0.43) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL11437153 0.73 CA2 (0.37) TSHRIDO1AGXTALDH1A1CA2
SCHEMBL2931114 0.72 TP53 (0.44) TSHRIDO1AGXTALDH1A1MAPT
SCHEMBL14702031 0.72 TSHR (0.52) TSHRIDO1AGXTALDH1A1CA1

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
CN-100475888-C Flame retardant polyester compositions for calendering EASTMAN CHEM CO (US) 2009-04-08 CN disclosed
CN-1974659-A Flame retardant polyester compositions for calendering, flame retardant thin film or sheet and production method thereof EASTMAN CHEM CO (US) 2007-06-06 CN disclosed
CN-1729240-A Flame retardant polyester compositions for calendering EASTMAN CHEM CO (US) 2006-02-01 CN disclosed