SCHEMBL4914822

SCHEMBL4914822

C=C(C)C(=O)OCCCC(=O)N(CC)CCOC(=O)C(=C)C

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.51
THRB P10828 1/20 0.49
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 3/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RAB9A P51151 2/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 4/20 0.36
DNM1 Q05193 1/20 0.31
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 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
SCHEMBL4917623 0.95 TSHR (0.54) TSHRTHRBLMNAPOLBAPEX1
SCHEMBL4916116 0.94 TSHR (0.57) TSHRTHRBLMNAPOLBAPEX1
SCHEMBL4915231 0.92 TSHR (0.51) TSHRTHRBLMNAPOLBAPEX1
SCHEMBL4916565 0.90 THRB (0.51) TSHRTHRBLMNAPOLBAPEX1
SCHEMBL4917946 0.85 TSHR (0.51) TSHRTHRBLMNAPOLBAPEX1
SCHEMBL4915581 0.84 TSHR (0.54) TSHRTHRBLMNAPOLBAPEX1
SCHEMBL27707440 0.82 THRB (0.52) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8917596 0.81 THRB (0.51) TSHRTHRBLMNAPOLBAPEX1
SCHEMBL4916318 0.81 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1327708 0.80 THRB (0.50) TSHRTHRBLMNAPOLBAPEX1

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-20080102262-A1 Radiation Curable Composition and Curing Product Thereof, and Laminate Including the Same MITSUBISHI CHEMICAL CORPORATION (JP) 2008-05-01 US disclosed