SCHEMBL2293680

SCHEMBL2293680

CCCOc1cc(O)c(-c2c(O)cc(OCCC)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.49
LTA4H P09960 2/20 0.43
PTGS1 P23219 2/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ALDH1A1 P00352 4/20 0.38
ALOX15 P16050 2/20 0.38
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
ATP2A2 P16615 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ATP2A3 Q93084 1/20 0.38
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
MIF P14174 1/20 0.36
TYR P14679 1/20 0.36

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
SCHEMBL2289370 0.92 LTA4H (0.46) ELANELTA4HALDH1A1MAPTGAA
SCHEMBL2288807 0.86 CA1 (0.41) ELANELTA4HPTGS1CA1CA2
SCHEMBL9150850 0.79 ALDH1A1 (0.53) LTA4HPTGS1ALDH1A1ALOX15KDM4E
SCHEMBL15064757 0.79 PTGS1 (0.48) ELANELTA4HPTGS1CA1CA2
SCHEMBL2292354 0.78 CA1 (0.38) CA1CA2ALDH1A1ALOX15KDM4E
SCHEMBL2004550 0.77 LTA4H (0.55) ELANELTA4HPTGS1SLC5A1SLC5A2
SCHEMBL12703529 0.77 LTA4H (0.55) ELANELTA4HPTGS1SLC5A1SLC5A2
SCHEMBL29888641 0.76 CA1 (0.67) ELANECA1CA2ALDH1A1ALOX15
SCHEMBL2295824 0.76 CA1 (0.67) ELANECA1CA2ALDH1A1ALOX15
SCHEMBL11796529 0.76 PTGS1 (0.45) ELANELTA4HPTGS1CA1CA2

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
EP-2346887-B1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES DOW TECHNOLOGY INVESTMENTS LLC (US) 2013-12-25 EP disclosed
US-8546600-B2 Slurry process for synthesis of bisphosphites and situ use thereof for producing bisphosphite DOW TECHNOLOGY INVESTMENTS LLC 2013-10-01 US disclosed
US-20110196166-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES AND SITU USE THEREOF FOR PRODUCING BISPHOSPHITE DOW TECHNOLOGY INVESTMENTS LLC 2011-08-11 US 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-20110196166-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES AND SITU USE THEREOF FOR PRODUCING BISPHOSPHITE SOST, PLCB3, PPIP5K2 ELANE 4831/4885LTA4H 2912/4885PTGS1 3032/4885

“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.