SCHEMBL6515513

SCHEMBL6515513

C=C(CC(=O)Oc1cccc(C)c1)C(=O)OCC(=O)c1cccc(C)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
GAA P10253 4/20 0.43
MAPT P10636 4/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 5/20 0.42
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 2/20 0.40
CTNNB1 P35222 1/20 0.40
WNT3A P56704 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6519118 0.94 KMT2A (0.42) LMNAGAAMAPTCYP1A2CYP3A4
SCHEMBL6519419 0.89 CTNNB1 (0.45) LMNAGAAMAPTKMT2AALDH1A1
SCHEMBL6516656 0.85 GAA (0.49) LMNAGAAMAPTCYP3A4KMT2A
SCHEMBL6520891 0.84 GAA (0.51) LMNAGAAMAPTCYP3A4KMT2A
SCHEMBL6519191 0.83 SMN1; SMN2 (0.42) LMNAGAAMAPTKMT2AALDH1A1
SCHEMBL6514663 0.82 SMN1; SMN2 (0.46) LMNAMAPTKMT2AALDH1A1TDP1
SCHEMBL6522220 0.82 KMT2A (0.45) LMNAMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL6519563 0.81 NPC1 (0.53) LMNAMAPTKMT2AALDH1A1MEN1
SCHEMBL6514457 0.81 NPC1 (0.53) LMNAMAPTKMT2AALDH1A1TDP1
SCHEMBL6520666 0.81 NPC1 (0.42) LMNAMAPTCYP2C19KMT2AALDH1A1

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 LMNA 2459/4885GAA 3231/4885MAPT 3438/4885

“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.