SCHEMBL8850423

SCHEMBL8850423

C=C(C)C(=O)OCC(CC)(CCC)COC(=O)C(=C)C

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
THRB P10828 2/20 0.43
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL2245821 0.92 TSHR (0.48) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL8851060 0.92 TSHR (0.48) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL268165 0.89 TSHR (0.51) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL28412602 0.88 THRB (0.53) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL8850718 0.88 THRB (0.48) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL28149678 0.88 THRB (0.48) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL23636 0.88 THRB (0.48) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL64442 0.87 TSHR (0.44) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL19342611 0.87 THRB (0.50) TSHRTHRBALDH1A1
SCHEMBL10391726 0.86 THRB (0.47) TSHRTHRBALDH1A1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661307-B1 Transparent resin and plastic lens HITACHI CHEMICAL CO LTD (JP) 1997-10-15 EP disclosed
US-5663264-A OF A COPOLYMER CONTAINING AN ALKYLENE OXIDE MONOMER, A POLYFUNCTIONAL (METH)ACRYLATE MONOMER AND A VINYL MONOMER HITACHI CHEMICAL COMPANY, LTD. (JP) 1997-09-02 US disclosed
US-5583191-A FORMED OF TRANSPARENT RESIN OBTAINED BY POLYMERIZING MONOMER HAVING ALKYLENE OXIDE GROUP, POLYFUNCTIONAL (METH)ACRYLATE HAVING DIVALENT BRANCED HYDROCARBON GROUP, OPTIONAL ADDITIONAL VINYL MONOMER; HEAT RESISTANCE HITACHI CHEMICAL COMPANY, LTD. (JP) 1996-12-10 US disclosed