SCHEMBL7940323

SCHEMBL7940323

Cc1cc(C(=O)OCCO)cc(C2(C)CCCCC2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.47
GLA P06280 1/20 0.40
TSHR P16473 1/20 0.40
ALOX12 P18054 1/20 0.40
SERPINE1 P05121 3/20 0.38
RARB P10826 2/20 0.36
RARG P13631 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
RARA P10276 1/20 0.36
AKR1C4 P17516 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
PTGDR Q13258 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
ACHE P22303 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
SCHEMBL7940424 0.86 GLA (0.41) ESR1GLATSHRALOX12SERPINE1
SCHEMBL7942020 0.85 SLC29A1 (0.38) ESR1TSHRRARBRARGMEN1
SCHEMBL8595689 0.84 GLA (0.38) ESR1GLATSHRALOX12SERPINE1
SCHEMBL7941409 0.82 RARB (0.50) ESR1TSHRSERPINE1RARBRARG
SCHEMBL7933829 0.81 GLA (0.38) GLATSHRALOX12RARBRARG
SCHEMBL7943238 0.79 ALOX5 (0.37) GLATSHRALOX12RARBRARG
SCHEMBL3810035 0.78 RARB (0.50) ESR1GLATSHRALOX12RARB
SCHEMBL7933836 0.77 SLC29A1 (0.38) TSHRRARBRARGMEN1KMT2A
SCHEMBL7940436 0.77 RARA (0.55) TSHRRARBRARGMEN1KMT2A
SCHEMBL7941148 0.73 ESR1 (0.48) ESR1SERPINE1MEN1KMT2AAKR1C4

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