SCHEMBL23601571

SCHEMBL23601571

C=C(C)C(=O)OCCC(O)COC(=O)c1ccc(I)cc1I

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 12/20 0.33
ADRB1 P08588 12/20 0.33
ADRB3 P13945 12/20 0.33
TSHR P16473 5/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
THRB P10828 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPK1 P28482 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
SCHEMBL23601568 0.84 TSHR (0.36) TSHRPOLBAPEX1HTTTDP1
SCHEMBL23601570 0.83 ADRB2 (0.41) ADRB2ADRB1ADRB3POLBAPEX1
SCHEMBL23601631 0.82 MAP2K1 (0.37) TSHRPOLBAPEX1HTTTDP1
SCHEMBL647275 0.81 TSHR (0.50) ADRB2ADRB1ADRB3TSHRTDP1
SCHEMBL23601638 0.80 ADRB2 (0.35) ADRB2ADRB1ADRB3TSHRALDH1A1
SCHEMBL27383300 0.79 ADRB2 (0.46) ADRB2ADRB1ADRB3POLBAPEX1
SCHEMBL23601634 0.78 TSHR (0.36) TSHRPOLBAPEX1HTTTDP1
SCHEMBL647274 0.77 ALDH1A1 (0.46) ADRB2ADRB1ADRB3TSHRPOLB
SCHEMBL23601563 0.77 POLB (0.47) ADRB2ADRB1ADRB3TSHRPOLB
SCHEMBL23601574 0.76 ADRB2 (0.35) ADRB2ADRB1ADRB3TSHRPOLB

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-20210200093-A1 COATING COMPOSITION FOR PHOTORESIST UNDERLAYER DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2021-07-01 US disclosed