SCHEMBL6520858

SCHEMBL6520858

C=C(CC(=O)Oc1ccc(C)cc1)C(=O)OCC(=O)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
LMNA P02545 1/20 0.47
NPC1 O15118 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
F2 P00734 1/20 0.41
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 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
SCHEMBL6523115 1.00 GAA (0.47) GAALMNANPC1L3MBTL1TDP1
SCHEMBL6518880 0.94 GAA (0.51) GAALMNANPC1L3MBTL1TDP1
SCHEMBL6517377 0.92 CYP19A1 (0.41) GAALMNAL3MBTL1TDP1ALDH1A1
SCHEMBL6513746 0.90 GAA (0.50) GAALMNANPC1L3MBTL1TDP1
SCHEMBL6524374 0.89 LMNA (0.49) GAALMNANPC1L3MBTL1TDP1
SCHEMBL6514394 0.89 LMNA (0.44) GAALMNANPC1L3MBTL1ALDH1A1
SCHEMBL6519563 0.88 NPC1 (0.53) LMNANPC1L3MBTL1ALDH1A1RAB9A
SCHEMBL6514457 0.88 NPC1 (0.53) LMNANPC1L3MBTL1TDP1ALDH1A1
SCHEMBL6515808 0.87 KMT2A (0.44) GAALMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL6520262 0.87 ALDH1A1 (0.44) GAALMNATDP1ALDH1A1MAPT

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 GAA 3231/4885LMNA 2459/4885NPC1 3563/4885

“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.