SCHEMBL7940436

SCHEMBL7940436

COc1ccc(C(=O)OCCO)cc1C1(C)CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 3/20 0.55
RARB P10826 3/20 0.55
RARG P13631 3/20 0.55
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
PTGDR Q13258 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
MAPK1 P28482 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B2 P37059 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
BRD4 O60885 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL7941409 0.86 RARB (0.50) RARARARBRARGKMT2AMEN1
SCHEMBL8401559 0.81 RARA (0.47) RARARARBRARGKMT2APTGDR
SCHEMBL7683179 0.80 RARB (0.66) RARARARBRARGKMT2AMEN1
SCHEMBL7689383 0.80 RARB (0.77) RARARARBRARGKMT2AMEN1
SCHEMBL7942020 0.80 SLC29A1 (0.38) RARARARBRARGKMT2AMEN1
Hydrochloric Acid SCHEMBL9738342 0.79 RARB (0.75) RARARARBRARGKMT2AMEN1
SCHEMBL9453324 0.79 RARB (0.61) RARARARBRARGPTGDRPTGDR2
SCHEMBL7944862 0.79 RARA (0.45) RARARARBRARGKMT2AMEN1
SCHEMBL7933836 0.79 SLC29A1 (0.38) RARARARBRARGKMT2AMEN1
SCHEMBL9493357 0.77 RARB (0.65) RARARARBRARGKMT2AMEN1

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
US-5891939-A POLYMER STABILIZERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-04-06 US disclosed