SCHEMBL7940424

SCHEMBL7940424

CCc1cc(C(=O)OCCO)cc(C2(C)CCCCC2)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.41
TSHR P16473 1/20 0.41
ALOX12 P18054 1/20 0.41
ESR1 P03372 8/20 0.38
NPSR1 Q6W5P4 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SERPINE1 P05121 3/20 0.37
AKR1C4 P17516 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
AKR1C1 Q04828 1/20 0.36
RARB P10826 2/20 0.35
RARG P13631 2/20 0.35
RARA P10276 1/20 0.35
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
PTGDR Q13258 1/20 0.34

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
SCHEMBL7940323 0.86 ESR1 (0.47) GLATSHRALOX12ESR1NPSR1
SCHEMBL7933836 0.86 SLC29A1 (0.38) TSHRMEN1KMT2ARARBRARG
SCHEMBL8595689 0.83 GLA (0.38) GLATSHRALOX12ESR1NPSR1
SCHEMBL7941409 0.81 RARB (0.50) TSHRESR1MEN1KMT2ASERPINE1
SCHEMBL7933973 0.81 GLA (0.40) GLATSHRALOX12NPSR1MEN1
SCHEMBL7786437 0.80 RARB (0.48) GLATSHRALOX12NPSR1MEN1
SCHEMBL7941462 0.79 GLA (0.39) GLATSHRALOX12NPSR1MEN1
SCHEMBL7942020 0.77 SLC29A1 (0.38) TSHRESR1MEN1KMT2ARARB
SCHEMBL7940436 0.76 RARA (0.55) TSHRNPSR1MEN1KMT2ARARB
SCHEMBL7942514 0.74 ESR1 (0.39) ESR1MEN1KMT2ASERPINE1AKR1C4

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
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
EP-0861847-A2 Stabilizer composition and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-09-02 EP disclosed