SCHEMBL13066079

SCHEMBL13066079

COCOc1cc(O)c2c(=O)cc(C3(O)C=CC(=O)C=C3)oc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.67
▸ NPC1 O15118 3/20 0.67
▸ LMNA P02545 3/20 0.67
▸ GSTO1 P78417 2/20 0.67
▸ RAB9A P51151 2/20 0.67
▸ KMT2A Q03164 2/20 0.67
▸ XBP1 P17861 1/20 0.67
▸ HTT P42858 1/20 0.67
▸ PTGS1 P23219 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ EGFR P00533 1/20 0.42
▸ RET P07949 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ FLT3 P36888 2/20 0.40
▸ IP6K2 Q9UHH9 2/20 0.40
▸ MAOB P27338 2/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ ABCB1 P08183 2/20 0.40
▸ CYP3A4 P08684 2/20 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
SCHEMBL2874820 0.87 MAPT (0.74) MAPTNPC1LMNAGSTO1RAB9A
Protoapigenone SCHEMBL13066080 0.81 KMT2A (1.00) MAPTNPC1LMNAGSTO1RAB9A
SCHEMBL15395297 0.78 HTT (0.76) MAPTNPC1LMNAGSTO1RAB9A
SCHEMBL30931536 0.74 PTGS1 (0.55) MAPTNPC1LMNAGSTO1RAB9A
SCHEMBL30931535 0.74 PTGS1 (0.55) MAPTNPC1LMNAGSTO1RAB9A
SCHEMBL2874541 0.73 MAPT (0.71) MAPTNPC1LMNAGSTO1RAB9A
SCHEMBL15245959 0.73 FLT3 (0.74) MAPTNPC1LMNARAB9AKMT2A
SCHEMBL24882669 0.72 EGFR (0.78) MAPTNPC1LMNAKMT2APTGS2
SCHEMBL13445691 0.71 KMT2A (0.80) MAPTNPC1LMNAGSTO1RAB9A
SCHEMBL3185003 0.70 MAOB (0.62) MAPTNPC1LMNARAB9AKMT2A

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-7842721-B2 Composition for treating cancer cells and synthetic method for the same KAOHSIUNG MEDICAL UNIVERSITY (TW) 2010-11-30 — — US disclosed
US-20090054516-A1 COMPOSITION FOR TREATING CANCER CELLS AND SYNTHETIC METHOD FOR THE SAME KAOHSIUNG MEDICAL UNIVERSITY (TW) 2009-02-26 — — 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-20090054516-A1 COMPOSITION FOR TREATING CANCER CELLS AND SYNTHETIC METHOD FOR THE SAME H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HK2, HCCS MAPT 4770/4885NPC1 1101/4885LMNA 2844/4885

“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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