SCHEMBL11435935

SCHEMBL11435935

C=CCOC(=O)CCO[PH](=O)OCCC(=O)OCC=C

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.49
TDP1 Q9NUW8 1/20 0.41
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 4/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
CYP3A4 P08684 1/20 0.35
EPHX2 P34913 1/20 0.34
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CASP1 P29466 1/20 0.32
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL27575770 0.87 ADRA2A (0.47) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL11435934 0.87 TSHR (0.47) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL3430112 0.79 TSHR (0.55) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL56403 0.79 TSHR (0.63) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL10749240 0.78 TSHR (0.53) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL14212039 0.77 TSHR (0.57) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL15847722 0.77 ABCC4 (0.35) TSHRMAPT
Ammonia Solution, Strong SCHEMBL29207431 0.77 TSHR (0.61) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL28545578 0.77 TSHR (0.61) TSHRTDP1PKMSMN1; SMN2ALDH1A1
SCHEMBL10906007 0.76 TSHR (0.52) TSHRTDP1PKMSMN1; SMN2ALDH1A1

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-4198310-A High voltage insulating compositions containing organic polymerizable phosphorus compounds RAYCHEM CORPORATION (US) 1980-04-15 US claimed