SCHEMBL13539277

SCHEMBL13539277

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

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.78
▸ ALPL P05186 3/20 0.78
▸ MAPT P10636 9/20 0.70
▸ NPC1 O15118 5/20 0.70
▸ RAB9A P51151 4/20 0.70
▸ LMNA P02545 6/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ ALOX12 P18054 2/20 0.53
▸ NFKB1 P19838 2/20 0.53
▸ NFKB2 Q00653 2/20 0.53
▸ RELA Q04206 2/20 0.53
▸ TP53 P04637 2/20 0.53
▸ USP2 O75604 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ NR0B1 P51843 1/20 0.53
▸ NPSR1 Q6W5P4 3/20 0.51
▸ HPGD P15428 2/20 0.51
▸ ACR P10323 1/20 0.51

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
SCHEMBL1415732 0.87 ALPL (1.00) KDM4EALPLMAPTNPC1RAB9A
SCHEMBL1416809 0.82 MAPT (1.00) KDM4EALPLMAPTNPC1RAB9A
SCHEMBL13541923 0.82 ALPL (0.70) KDM4EALPLMAPTNPC1RAB9A
SCHEMBL13971739 0.78 MAPT (0.62) KDM4EALPLMAPTNPC1RAB9A
SCHEMBL14138506 0.75 KDM4E (0.62) KDM4EALPLMAPTNPC1RAB9A
SCHEMBL13539274 0.75 ALPL (0.77) ALPLMAPTRAB9ALMNAMEN1
SCHEMBL13539269 0.74 ALPL (0.73) ALPLMAPTNPC1RAB9ALMNA
SCHEMBL13539275 0.74 ALPL (0.76) ALPLMAPTNPC1RAB9ALMNA
SCHEMBL19533624 0.74 ALPL (0.47) KDM4EALPLMAPTNPC1RAB9A
SCHEMBL13175674 0.73 ALPL (0.54) KDM4EALPLMAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-01-21 — — 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-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF ALPI, SI, FABP2 KDM4E 2989/4885ALPL 5/4885MAPT 4675/4885

“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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