SCHEMBL6565809

SCHEMBL6565809

COc1c(C(C)(C)C)cc(CCO)cc1C(C)(C)CC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.37
PTGS2 P35354 3/20 0.34
TNKS2 Q9H2K2 1/20 0.33
TNFRSF1A P19438 2/20 0.33
CYP3A4 P08684 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GSR P00390 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
KCNH2 Q12809 2/20 0.32
MEN1 O00255 1/20 0.32
GMNN O75496 1/20 0.32
GABBR2 O75899 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL6568779 0.93 TNKS2 (0.42) DHFRPTGS2TNKS2TNFRSF1ACYP3A4
SCHEMBL6567279 0.89 DHFR (0.43) DHFRPTGS2TNKS2TNFRSF1ACYP3A4
SCHEMBL6567275 0.87 TNKS2 (0.33) TNKS2CYP3A4SMN1; SMN2LMNA
SCHEMBL6567472 0.86 DHFR (0.38) DHFRPTGS2TNKS2TNFRSF1ACYP3A4
SCHEMBL6565884 0.84 MAPT (0.35) DHFRPTGS2TNKS2CYP3A4SMN1; SMN2
SCHEMBL7796625 0.83 GAA (0.39) TNFRSF1AKCNH2KMT2AVCAM1
SCHEMBL6565810 0.83 PTGS2 (0.38) DHFRPTGS2TNFRSF1A
SCHEMBL7944894 0.82 ALOX5 (0.38) CYP3A4SMN1; SMN2ALDH1A1KMT2AVCAM1
SCHEMBL6568715 0.82 TNKS2 (0.49) DHFRPTGS2TNKS2TNFRSF1ACYP3A4
SCHEMBL6566985 0.81 TNKS2 (0.44) DHFRPTGS2TNKS2TNFRSF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1484334-A2 Process for producing phosphite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-12-08 EP disclosed
US-20040225145-A1 Process for producing phosphite SUMITOMO CHEMICAL COMPANY, LIMITED 2004-11-11 US disclosed
EP-0823435-B1 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL CO (JP) 2001-11-21 EP disclosed
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-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040225145-A1 Process for producing phosphite PHOSPHO1, PLCG1, PLCG2 DHFR 3533/4885PTGS2 2133/4885TNKS2 3019/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.