SCHEMBL8401581

SCHEMBL8401581

CCC(=O)Oc1cc(C)c(OC)c(C2(C)CCCCC2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.39
RARB P10826 3/20 0.37
RARG P13631 3/20 0.37
RARA P10276 2/20 0.37
ALDH1A1 P00352 2/20 0.36
PTGDR Q13258 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
KDM4E B2RXH2 1/20 0.33
PTPN1 P18031 2/20 0.33
ESR1 P03372 2/20 0.33
HIF1A Q16665 2/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 2/20 0.32
GLA P06280 1/20 0.32
ALOX12 P18054 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 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
SCHEMBL8400764 0.88 RARB (0.37) ACHERARBRARGRARAALDH1A1
SCHEMBL8397568 0.86 RARB (0.34) RARBRARGRARAALDH1A1PTGDR
SCHEMBL7933771 0.86 RARB (0.39) ACHERARBRARGRARAPTGDR
SCHEMBL8432818 0.85 OPRM1 (0.35) RARBRARGRARAPTGDRPTGDR2
SCHEMBL8399068 0.85 TSHR (0.41) ACHERARBRARGRARAALDH1A1
SCHEMBL8400788 0.84 RARB (0.35) ACHERARBRARGRARAPTGDR
SCHEMBL8397572 0.79 RARA (0.53) ACHERARBRARGRARAALDH1A1
SCHEMBL8400776 0.77 ALOX5 (0.43) RARBRARGRARAALDH1A1PTGDR
SCHEMBL8400759 0.77 GLA (0.44) ACHERARBRARGRARAALDH1A1
SCHEMBL8401696 0.76 RARB (0.48) ACHERARBRARGRARAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
US-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed