SCHEMBL9634868

SCHEMBL9634868

C=CC(=O)OCCCc1c(C(=O)O)ccc(C(=O)O)c1CCCOC(=O)C=C

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.52
ALDH1A1 P00352 4/20 0.52
CYP3A4 P08684 1/20 0.52
THRB P10828 4/20 0.51
HPGD P15428 1/20 0.47
TP53 P04637 2/20 0.47
HIF1A Q16665 2/20 0.47
HSD17B10 Q99714 1/20 0.47
AKR1B10 O60218 3/20 0.37
AKR1B1 P15121 3/20 0.37
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
ALOX5 P09917 1/20 0.33

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
SCHEMBL9633050 0.95 TSHR (0.55) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL30049181 0.91 THRB (0.47) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL9634091 0.90 THRB (0.54) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL9634899 0.87 THRB (0.43) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL4578637 0.87 THRB (0.43) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL29487385 0.87 TSHR (0.49) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL1265100 0.87 TSHR (0.49) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL29367471 0.86 TSHR (0.51) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL30049822 0.86 TSHR (0.51) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL29596732 0.86 TSHR (0.51) TSHRALDH1A1CYP3A4THRBHPGD

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
US-5122436-A Homogeneous blend of polyimidesiloxane and unsaturated monomer EASTMAN KODAK COMPANY (US) 1992-06-16 US disclosed
US-5098814-A Integrated circuit chips of laminates of flexible metal strips and photoresists of polyimidesiloxane copolymers EASTMAN KODAK COMPANY (US) 1992-03-24 US disclosed