SCHEMBL11420153

SCHEMBL11420153

C=C(C)C(=O)OCC(OC(=O)C(=C)C)c1ccccc1.C=C(C)C(=O)OCCOCCOCCOCCOC(=O)C(=C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
TSHR P16473 3/20 0.41
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PABPC1 P11940 1/20 0.37
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
KMT2A Q03164 1/20 0.36
HPGD P15428 1/20 0.35
EPHX2 P34913 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CHRM2 P08172 2/20 0.34
CHRM4 P08173 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 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
SCHEMBL57281 0.92 TSHR (0.47) TSHRPOLBAPEX1HTTTDP1
Ethylene Glycol SCHEMBL21772119 0.88 TSHR (0.44) TSHRPOLBAPEX1HTTTDP1
SCHEMBL27371666 0.83 POLB (0.42) THRBTSHRPOLBAPEX1HTT
SCHEMBL9334380 0.83 TSHR (0.40) TSHRPOLBAPEX1HTTTDP1
SCHEMBL10489043 0.81 EPHX2 (0.37) TSHRPOLBAPEX1HTTTDP1
SCHEMBL15385968 0.79 POLB (0.45) KDM4EPOLBAPEX1HTTTDP1
SCHEMBL15386006 0.78 EPHX2 (0.46) THRBTSHRKDM4EPOLBAPEX1
SCHEMBL15864686 0.78 TSHR (0.45) TSHRPOLBAPEX1HTTTDP1
SCHEMBL3784433 0.77 TSHR (0.38) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1372183 0.77 HPGD (0.42) KDM4EPOLBPABPC1APOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4214047-A Photographic elements having hydrophilic colloid layers containing hydrophobic addenda uniformly loaded in latex polymer particles EASTMAN KODAK COMPANY (US) 1980-07-22 US disclosed