SCHEMBL16225752

SCHEMBL16225752

CC(=O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.58
▸ CDK4 P11802 2/20 0.58
▸ CCND1 P24385 2/20 0.58
▸ ELANE P08246 2/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ CYP3A4 P08684 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ POLB P06746 2/20 0.57
▸ MAPT P10636 2/20 0.57
▸ APEX1 P27695 2/20 0.57
▸ MAPK1 P28482 2/20 0.57
▸ TDP1 Q9NUW8 2/20 0.57
▸ HSD17B10 Q99714 2/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ PTP4A3 O75365 1/20 0.57
▸ GMNN O75496 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ ESR1 P03372 1/20 0.57
▸ TP53 P04637 1/20 0.57

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
SCHEMBL16226740 0.88 ELANE (0.62) EGFRCDK4CCND1ELANEMEN1
SCHEMBL29711665 0.86 ELANE (0.50) EGFRCDK4CCND1ELANEMEN1
SCHEMBL23522434 0.86 MEN1 (0.54) EGFRCDK4CCND1ELANEMEN1
SCHEMBL18262001 0.83 MEN1 (0.54) EGFRCDK4CCND1ELANEMEN1
SCHEMBL29390162 0.79 ESR1 (0.77) EGFRCDK4CCND1ELANEMEN1
SCHEMBL5968219 0.79 ESR1 (0.77) EGFRCDK4CCND1ELANEMEN1
SCHEMBL29359585 0.79 ELANE (0.62) EGFRCDK4CCND1ELANEMEN1
SCHEMBL23199115 0.79 ELANE (0.62) EGFRCDK4CCND1ELANEMEN1
SCHEMBL23486220 0.79 ALDH1A1 (0.73) EGFRCDK4CCND1ELANEMEN1
SCHEMBL23486215 0.78 MEN1 (0.54) EGFRCDK4CCND1ELANEMEN1

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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 — — 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 EGFR 656/4885CDK4 1290/4885CCND1 1641/4885

“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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