SCHEMBL6516142

SCHEMBL6516142

C=C(CC(=O)OCCOCCCC)C(=O)OCC(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
RARB P10826 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPT P10636 3/20 0.39
NPC1 O15118 6/20 0.39
RAB9A P51151 6/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GAA P10253 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL6520734 0.90 MAPT (0.42) RARBL3MBTL1KMT2AALDH1A1MAPT
SCHEMBL6515223 0.89 MAPT (0.42) L3MBTL1KMT2AMEN1ALDH1A1CYP1A2
SCHEMBL6515096 0.85 TSHR (0.46) TSHRRECQLRARBKMT2AMEN1
SCHEMBL6514707 0.84 KMT2A (0.43) TSHRL3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL6520700 0.83 TDP1 (0.44) TSHRRECQLKMT2AMEN1ALDH1A1
SCHEMBL6517409 0.82 ALDH1A1 (0.50) L3MBTL1KMT2AMEN1ALDH1A1CYP1A2
SCHEMBL6513324 0.82 KMT2A (0.50) L3MBTL1KMT2AMEN1ALDH1A1CYP1A2
SCHEMBL6519432 0.81 FAAH (0.39) TSHRRARBL3MBTL1ALDH1A1HPGD
SCHEMBL6515076 0.81 DGKA (0.38) TSHRRARBALDH1A1MAPTHPGD
SCHEMBL9056869 0.81 THRB (0.43) TSHRRARBKMT2AMEN1ALDH1A1

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 TSHR 3581/4885RECQL 2058/4885RARB 1177/4885

“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.