SCHEMBL402934

SCHEMBL402934

COc1ccc(COC2COC3COC(C)(C)O[C@H]3[C@H]2OCc2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 1/20 0.38
▸ KCNA5 P22460 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ BCHE P06276 1/20 0.35
▸ LTA4H P09960 1/20 0.35
▸ REN P00797 2/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL21572017 0.84 BCHE (0.44) BCHESIGMAR1MAPTCYP2C19
SCHEMBL402863 0.82 BCHE (0.46) L3MBTL1BCHESIGMAR1MAPTCYP2C19
SCHEMBL402935 0.80 PDPK1 (0.37) L3MBTL1BCHESIGMAR1MAPTCYP2C19
SCHEMBL16404640 0.79 KMT2A (0.36) TACR1L3MBTL1RENMEN1KMT2A
SCHEMBL3857852 0.78 LTA4H (0.47) TACR1KCNA5L3MBTL1BCHELTA4H
SCHEMBL15481393 0.78 L3MBTL1 (0.39) TACR1L3MBTL1MEN1KMT2AMAPT
SCHEMBL1964688 0.78 KMT2A (0.37) TACR1L3MBTL1RENMEN1KMT2A
SCHEMBL22726958 0.75 KMT2A (0.46) TACR1RENMEN1KMT2AALDH1A1
SCHEMBL10892517 0.74 CA1 (0.50) TACR1L3MBTL1RENMEN1KMT2A
SCHEMBL16560364 0.74 MEN1 (0.34) TACR1L3MBTL1RENMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF SANOFI-AVENTIS (FR) 2012-03-15 — — US disclosed
US-20070270354-A1 Azasugar derivatives, heparanase inhibitors, method for preparing same, compositions containing same, use thereof SANOFI-AVENTIS (FR) 2007-11-22 — — 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 (2 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-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF HPSE, HAAO, HEXD TACR1 531/4885KCNA5 1814/4885L3MBTL1 4789/4885
US-20070270354-A1 Azasugar derivatives, heparanase inhibitors, method for preparing same, compositions containing same, use thereof HPSE, HAAO, HEXD TACR1 526/4885KCNA5 1806/4885L3MBTL1 4789/4885

“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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