SCHEMBL17085404

SCHEMBL17085404

COCOc1cc(C2Oc3ccccc3C(=O)C2O)ccc1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ SMN1; SMN2 Q16637 6/20 0.45
▸ MAPT P10636 5/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ HPGD P15428 2/20 0.45
▸ AGTR1 P30556 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ RAB9A P51151 1/20 0.42

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
SCHEMBL16485511 0.86 SMN1; SMN2 (0.47) RETKDRSMN1; SMN2MAPTKDM4E
SCHEMBL17085406 0.81 KDM4E (0.40) SMN1; SMN2MAPTKDM4EHPGDLMNA
SCHEMBL28320416 0.79 ALDH1A1 (0.56) MAPTKDM4EHPGDLMNAALDH1A1
SCHEMBL16048625 0.78 PDE4A (0.41) RETKDRMAPTLMNAALDH1A1
SCHEMBL25434717 0.78 ALDH1A1 (0.56) SMN1; SMN2MAPTKDM4EHPGDAGTR1
SCHEMBL30576367 0.78 ALDH1A1 (0.56) SMN1; SMN2MAPTKDM4EHPGDAGTR1
SCHEMBL25434723 0.78 ALDH1A1 (0.56) SMN1; SMN2MAPTKDM4EHPGDAGTR1
SCHEMBL7242379 0.76 ALDH1A1 (0.57) MAPTKDM4EHPGDLMNAALDH1A1
SCHEMBL10608985 0.75 ALDH1A1 (0.67) SMN1; SMN2MAPTKDM4EHPGDAGTR1
SCHEMBL21722487 0.75 CYP2C9 (0.61) MAPTKDM4EHPGDLMNAALDH1A1

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-20150259373-A1 NOVEL FLAVONOID COMPOUNDS AND USES THEREOF ARMARON BIO PTY LTD (AU) 2015-09-17 — — 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-20150259373-A1 NOVEL FLAVONOID COMPOUNDS AND USES THEREOF BAX, CASP3, BAD RET 3008/4885KDR 456/4885SMN1; SMN2 2115/4885

“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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