SCHEMBL7942538

SCHEMBL7942538

COc1c(C)cc(C(=O)OCCO)cc1C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.39
SLC29A1 Q99808 6/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 2/20 0.38
KMT2A Q03164 2/20 0.38
SCN1A P35498 2/20 0.38
SCN2A Q99250 2/20 0.38
SCN3A Q9NY46 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
ABCC4 O15439 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
MAPK1 P28482 1/20 0.38
SLC6A4 P31645 1/20 0.38

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
SCHEMBL7944751 0.87 THRB (0.39) THRBSLC29A1SMN1; SMN2MEN1LMNA
SCHEMBL7944907 0.86 THRB (0.38) THRBSLC29A1SMN1; SMN2MEN1LMNA
SCHEMBL7941148 0.85 ESR1 (0.48) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL8430286 0.81 L3MBTL1 (0.45) SMN1; SMN2MEN1KMT2AALDH1A1CYP2C9
SCHEMBL7796616 0.80 KMT2A (0.47) KMT2AALDH1A1PTGDR2PKMTDP1
SCHEMBL7933549 0.80 ALDH1A1 (0.47) THRBMEN1KMT2AALDH1A1
SCHEMBL7944788 0.79 PTGDR2 (0.47) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL7942514 0.77 ESR1 (0.39) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL7940670 0.75 GAA (0.38) SMN1; SMN2MEN1LMNAKMT2AALDH1A1
SCHEMBL7942020 0.75 SLC29A1 (0.38) SLC29A1SMN1; SMN2MEN1LMNAKMT2A

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