SCHEMBL6568830

SCHEMBL6568830

CCc1cc(CCO)cc(C2CCCCC2)c1OC

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
HTR2A P28223 3/20 0.38
PTGDR2 Q9Y5Y4 3/20 0.36
NUDT1 P36639 1/20 0.36
BACE1 P56817 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
PTGDR Q13258 1/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PTGS2 P35354 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 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
SCHEMBL6567755 0.92 TNKS2 (0.40) ALDH1A1HTR2APTGDR2NUDT1BACE1
SCHEMBL7794938 0.86 THRA (0.47) ALDH1A1PTGDR2SIGMAR1
SCHEMBL7941368 0.86 ALDH1A1 (0.47) ALDH1A1PTGDR2SIGMAR1POLB
SCHEMBL6568807 0.83 ALDH1A1 (0.38) ALDH1A1HTR2APTGDR2NUDT1BACE1
SCHEMBL7796573 0.83 THRB (0.46) ALDH1A1PTGDR2SIGMAR1PTGDRTDP1
SCHEMBL8433312 0.82 L3MBTL1 (0.44) ALDH1A1PTGDR2PTGDRPOLB
SCHEMBL3814399 0.82 NUDT1 (0.41) HTR2APTGDR2NUDT1BACE1KDM4E
SCHEMBL6567759 0.81 ALDH1A1 (0.36) ALDH1A1HTR2APTGDR2NUDT1BACE1
SCHEMBL7796140 0.77 PTGDR2 (0.42) HTR2APTGDR2PTGDRTDP1
SCHEMBL7944751 0.76 THRB (0.39) ALDH1A1HTR2APTGDR2MAPTTDP1

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 ALDH1A1 4488/4885HTR2A 4188/4885PTGDR2 2095/4885

“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.