SCHEMBL10030792

SCHEMBL10030792

CCOc1ccc(/C=C\c2cc(CO)c(CO)c(OC)c2)cc1OP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB1 Q9H4B7 5/20 0.47
▸ MAPT P10636 3/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ ABL1 P00519 1/20 0.43
▸ ABCB1 P08183 1/20 0.43
▸ BCR P11274 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ FDPS P14324 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MMP2 P08253 1/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ MMP8 P22894 1/20 0.40

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
SCHEMBL17145748 0.92 MMP2 (0.44) TUBB1ABCB1ALDH1A1KDM4EMMP2
SCHEMBL13778143 0.92 CYP1A1 (0.46) TUBB1ABCB1ALDH1A1HPGDKDM4E
SCHEMBL14414505 0.89 CYP1A1 (0.47) TUBB1ABCB1ALDH1A1HPGDKDM4E
SCHEMBL13479903 0.85 CYP1A1 (0.50) TUBB1ABCB1ALDH1A1KMT2AMEN1
SCHEMBL13050763 0.84 TUBB1 (0.58) TUBB1MAPTNPC1RAB9AABCB1
SCHEMBL17145726 0.83 CYP1A1 (0.42) TUBB1MAPTNPC1RAB9AALDH1A1
SCHEMBL17145756 0.83 CYP1A1 (0.44) TUBB1ABCB1ALDH1A1HPGDKDM4E
SCHEMBL14379932 0.83 CYP1A1 (0.46) TUBB1ABCB1ALDH1A1HPGDKDM4E
SCHEMBL17145755 0.83 TUBB1 (0.45) TUBB1MAPTABL1ABCB1BCR
SCHEMBL13079742 0.83 TUBB1 (0.65) TUBB1ABL1ABCB1BCRMMP2

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-20120046492-A1 Ethoxy Diphenyl Ethane Derivatives, Preparation Processes and Uses Thereof Zhejiang Wild Wind Pharmaceutical Co., Ltd. (CN) 2012-02-23 — — 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-20120046492-A1 Ethoxy Diphenyl Ethane Derivatives, Preparation Processes and Uses Thereof TUBB1, TUBB, TUBB3 TUBB1 1/4885MAPT 94/4885NPC1 2413/4885

“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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