SCHEMBL30122657

SCHEMBL30122657

C=C(C)C(=O)OC(C)CC.CCC=C(C)C(=O)O.CCC=C(C)C(=O)O.CCC=C(C)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL1532814 0.86 TSHR (0.37) TSHRTHRBALDH1A1
Methacrylic Acid SCHEMBL7860381 0.85 TSHR (0.44) TSHRTP53THRBALDH1A1
Acrylic Acid SCHEMBL22129803 0.83 TSHR (0.40) TSHRTP53THRBALDH1A1
SCHEMBL29425575 0.83 TSHR (0.35) TSHRTP53THRB
SCHEMBL33467 0.83 TSHR (0.48) TSHRTP53THRBALDH1A1
SCHEMBL28322415 0.81 TSHR (0.47) TSHRTP53THRBALDH1A1
SCHEMBL27805092 0.81 TSHR (0.47) TSHRTP53THRBALDH1A1
SCHEMBL28322566 0.81 TSHR (0.47) TSHRTP53THRBALDH1A1
SCHEMBL27707671 0.79 TSHR (0.41) TSHRALDH1A1
SCHEMBL9175672 0.79 TSHR (0.32) TSHRTP53

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
EP-4100448-A1 HIGH TG ACRYLATE COPOLYMERS WITH NITROGEN-CONTAINING AROMATIC HETEROCYCLIC GROUP tesa SE (DE) 2022-12-14 EP disclosed