SCHEMBL9639714

SCHEMBL9639714

COC(=O)C(=C(C(=O)OC)c1ccccc1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.60
SRC P12931 1/20 0.48
CES1 P23141 6/20 0.47
CES2 O00748 4/20 0.47
KMT2A Q03164 2/20 0.46
ALOX15 P16050 2/20 0.46
CYP3A4 P08684 2/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
F2 P00734 1/20 0.46
DAO P14920 1/20 0.46
NAPRT Q6XQN6 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HDAC3 O15379 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
SCHEMBL28894376 1.00 TSHR (0.60) TSHRSRCCES1CES2KMT2A
SCHEMBL12588750 0.89 TSHR (0.54) TSHRSRCCES1CES2KMT2A
SCHEMBL10606385 0.89 TSHR (0.54) TSHRSRCCES1CES2KMT2A
SCHEMBL28678433 0.87 TSHR (0.52) TSHRSRCCES1CES2KMT2A
SCHEMBL11744565 0.87 TSHR (0.52) TSHRSRCCES1CES2KMT2A
SCHEMBL4957182 0.87 TSHR (0.52) TSHRSRCCES1CES2KMT2A
SCHEMBL12549172 0.87 TSHR (0.52) TSHRSRCCES1CES2KMT2A
SCHEMBL3736621 0.86 TSHR (0.50) TSHRSRCCES1CES2KMT2A
SCHEMBL27939248 0.86 TSHR (0.50) TSHRSRCCES1CES2KMT2A
SCHEMBL13354336 0.84 TSHR (0.48) TSHRSRCCES1CES2KMT2A

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
US-5164100-A Stilbene unit incorporated into polyester LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1992-11-17 US disclosed
US-5082578-A Fabric care compositions containing a polymeric fluorescent whitening agent LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1992-01-21 US disclosed
US-5039782-A Containing a fluorescent group and a hydrophilic group; antisoilants LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1991-08-13 US disclosed
US-3953498-A Diesters and diacids of phenanthrene GULF RESEARCH & DEVELOPMENT COMPANY (US) 1976-04-27 US disclosed