SCHEMBL4903979

SCHEMBL4903979

O=Cc1nccc(OCc2ccccc2)c1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CCNB2 O95067 1/20 0.45
CDK1 P06493 1/20 0.45
CDK4 P11802 1/20 0.45
CCNB1 P14635 1/20 0.45
CCND1 P24385 1/20 0.45
CCNB3 Q8WWL7 1/20 0.45
LTA4H P09960 1/20 0.44
MAPK14 Q16539 1/20 0.44
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ABCB1 P08183 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 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
SCHEMBL4688019 0.90 HTR1A (0.43) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL9237762 0.90 BCHE (0.49) L3MBTL1LMNAHTR1AADRA1DADRA1A
SCHEMBL4157654 0.89 ABCB1 (0.49) NPC1RAB9ASMN1; SMN2LTA4HMAOB
SCHEMBL15088139 0.85 HTR1A (0.38) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL19463829 0.83 THRA (0.43) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL1178876 0.81 LTA4H (0.58) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL9682833 0.81 BCHE (0.41) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL9682829 0.81 BCHE (0.41) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL9682277 0.79 HTR1A (0.42) L3MBTL1NPC1RAB9ASMN1; SMN2CCNB2
SCHEMBL7720531 0.77 LTA4H (0.49) MAPTL3MBTL1SMN1; SMN2LTA4HMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200520-A1 Iron Modulators BTG INTERNATIONAL LIMITED 2008-08-21 US disclosed
WO-2006103463-A1 IRON MODULATORS BTG INTERNATIONAL LIMITED (GB) 2006-10-05 WO disclosed
WO-1992013841-A1 COMPLEXING AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1992-08-20 WO disclosed
EP-0498380-A1 Complexing agents BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1992-08-12 EP 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-20080200520-A1 Iron Modulators SLC40A1, HAMP, FTH1 MAPT 109/4885L3MBTL1 793/4885NPC1 502/4885

“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.