SCHEMBL1416809

SCHEMBL1416809

CCOC(=O)c1cc(-c2ccc3c(c2)OCCO3)n[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 1.00
▸ RAB9A P51151 5/20 1.00
▸ ALPL P05186 4/20 1.00
▸ NPC1 O15118 4/20 1.00
▸ KDM4E B2RXH2 4/20 0.67
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ KMT2A Q03164 4/20 0.55
▸ HPGDS O60760 2/20 0.51
▸ ACR P10323 2/20 0.51
▸ TP53 P04637 3/20 0.50
▸ CASP3 P42574 1/20 0.50
▸ SENP8 Q96LD8 1/20 0.50
▸ SENP7 Q9BQF6 1/20 0.50
▸ SENP6 Q9GZR1 1/20 0.50
▸ HSD17B10 Q99714 3/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ POLB P06746 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ CASP1 P29466 2/20 0.47

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
SCHEMBL13539277 0.82 KDM4E (0.78) MAPTRAB9AALPLNPC1KDM4E
SCHEMBL1415732 0.81 ALPL (1.00) MAPTRAB9AALPLNPC1KDM4E
SCHEMBL19544616 0.78 ALPL (0.65) MAPTRAB9AALPLNPC1L3MBTL1
SCHEMBL17895628 0.78 ALPL (0.72) MAPTRAB9AALPLNPC1L3MBTL1
SCHEMBL25168483 0.77 ALPL (0.76) MAPTRAB9AALPLNPC1L3MBTL1
SCHEMBL1413959 0.77 ALPL (1.00) MAPTRAB9AALPLNPC1L3MBTL1
SCHEMBL2824803 0.77 ALPL (0.76) MAPTRAB9AALPLNPC1L3MBTL1
SCHEMBL595997 0.77 ALPL (0.75) MAPTRAB9AALPLNPC1L3MBTL1
SCHEMBL2888912 0.76 MAPT (1.00) MAPTRAB9AALPLNPC1L3MBTL1
SCHEMBL23755314 0.76 MAPT (0.70) MAPTRAB9AALPLNPC1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2291372-A2 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF Burnham Institute for Medical Research (US) 2011-03-09 — — EP disclosed
US-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-01-21 — — US disclosed
US-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-01-21 — — US disclosed
WO-2009143150-A2 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2009-11-26 — — WO 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-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF ALPI, SI, FABP2 MAPT 4675/4885RAB9A 1635/4885ALPL 5/4885

“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.

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