SCHEMBL2289370

SCHEMBL2289370

CCCCOc1cc(O)c(-c2c(O)cc(OCCCC)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.46
NR5A1 Q13285 1/20 0.46
GAA P10253 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
XBP1 P17861 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GPR84 Q9NQS5 1/20 0.42
ELANE P08246 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
CNR1 P21554 7/20 0.41
CNR2 P34972 7/20 0.41
PLA2G2A P14555 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
SCHEMBL2293680 0.92 ELANE (0.49) LTA4HNR5A1GAAL3MBTL1XBP1
SCHEMBL2288807 0.84 CA1 (0.41) LTA4HGAAL3MBTL1XBP1ATM
SCHEMBL10990333 0.84 CA2 (0.55) LTA4HNR5A1GAAL3MBTL1XBP1
SCHEMBL2815926 0.81 GAA (0.58) LTA4HNR5A1GAAL3MBTL1XBP1
SCHEMBL15064805 0.80 CA2 (0.46) LTA4HNR5A1GAAL3MBTL1XBP1
SCHEMBL1086609 0.78 CA1 (0.52) LTA4HNR5A1MAPTCNR1CNR2
SCHEMBL6693439 0.78 CA1 (0.52) LTA4HNR5A1MAPTCNR1CNR2
SCHEMBL9999756 0.78 CA1 (0.52) LTA4HNR5A1MAPTCNR1CNR2
SCHEMBL7307689 0.78 LTA4H (0.59) LTA4HNR5A1GAAL3MBTL1GPR84
SCHEMBL10764141 0.78 LTA4H (0.59) LTA4HNR5A1GAAL3MBTL1GPR84

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 LTA4H 2912/4885NR5A1 2872/4885GAA 4660/4885

“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.