SCHEMBL6515212

SCHEMBL6515212

C=C(CC(=O)OC1CCCCC1)C(=O)OCC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 2/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.40
CYP2D6 P10635 2/20 0.39
MAPT P10636 3/20 0.39
CYP19A1 P11511 1/20 0.39
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN3A Q9NY46 1/20 0.38
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
CXCR1 P25024 1/20 0.38

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
SCHEMBL6516328 0.99 MEN1 (0.44) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL6521080 0.88 ALDH1A1 (0.42) ALDH1A1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL6519526 0.88 ALDH1A1 (0.42) ALDH1A1KMT2ACYP1A2CYP2C19LMNA
SCHEMBL6520666 0.85 NPC1 (0.42) ALDH1A1KMT2ACYP2C19LMNARAB9A
SCHEMBL6513801 0.84 ALDH1A1 (0.42) ALDH1A1LMNARAB9ACYP19A1HPGD
SCHEMBL6520993 0.83 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL6520550 0.82 NPC1 (0.42) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL6515141 0.82 CYP19A1 (0.44) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL6514907 0.82 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ACYP19A1L3MBTL1
SCHEMBL22615603 0.82 CYP2C19 (0.40) ALDH1A1CYP2C19LMNARAB9ACYP19A1

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 ALDH1A1 1254/4885MEN1 3248/4885KMT2A 1067/4885

“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.