SCHEMBL6523592

SCHEMBL6523592

O=C(/C=C/C(=O)Oc1ccccc1)OCC(=O)c1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.54
PTPN1 P18031 1/20 0.48
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
NR4A1 P22736 1/20 0.45
NR4A2 P43354 1/20 0.45
NR4A3 Q92570 1/20 0.45
MAPT P10636 5/20 0.45
HPGD P15428 4/20 0.45
ALDH1A1 P00352 3/20 0.45
HSP90AA1 P07900 1/20 0.45
HTT P42858 1/20 0.45
KDM4E B2RXH2 5/20 0.43
TDP1 Q9NUW8 3/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
GMNN O75496 2/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 2/20 0.43
MAPK1 P28482 2/20 0.43

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
SCHEMBL6515144 0.90 NPC1 (0.50) NPC1PTPN1FNTAFNTBMAPT
SCHEMBL6515390 0.85 NPC1 (0.56) NPC1PTPN1FNTAFNTBNR4A1
SCHEMBL6514656 0.85 NPC1 (0.55) NPC1PTPN1FNTAFNTBMAPT
SCHEMBL6523946 0.82 NPC1 (0.52) NPC1PTPN1FNTAFNTBMAPT
SCHEMBL6517313 0.78 KMT2A (0.56) NPC1MAPTHPGDALDH1A1KDM4E
SCHEMBL6518396 0.78 NPC1 (0.48) NPC1PTPN1FNTAFNTBMAPT
SCHEMBL6522136 0.77 ALDH1A1 (0.48) NPC1MAPTHPGDALDH1A1KDM4E
SCHEMBL6518026 0.76 NPC1 (0.46) NPC1PTPN1FNTAFNTBNR4A1
SCHEMBL27832230 0.76 NPC1 (0.77) NPC1PTPN1FNTAFNTBNR4A1
SCHEMBL4828442 0.75 NPC1 (0.59) NPC1PTPN1FNTAFNTBNR4A1

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-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 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-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 NPC1 3563/4885PTPN1 3105/4885FNTA 967/4885

“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.