SCHEMBL6515037

SCHEMBL6515037

CC1CCC(OC(=O)COC(=O)/C=C/C(=O)OCC(=O)OC2CCC(C)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.44
HCAR2 Q8TDS4 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 2/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
NAAA Q02083 2/20 0.33
ATM Q13315 1/20 0.32
MAPT P10636 3/20 0.32
RAB9A P51151 1/20 0.32
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31

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
SCHEMBL6519700 0.84 NAAA (0.43) CYP19A1TDP1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL7040880 0.84 NAAA (0.43) CYP19A1TDP1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL6513399 0.82 CYP2C19 (0.46) CYP19A1TDP1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL6523231 0.82 NAAA (0.46) CYP19A1HCAR2TDP1L3MBTL1ALDH1A1
SCHEMBL31190381 0.81 HCAR2 (0.50) CYP19A1HCAR2L3MBTL1ALDH1A1LMNA
SCHEMBL6514416 0.81 NAAA (0.41) CYP19A1ALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL6516594 0.80 HCAR2 (0.42) CYP19A1HCAR2L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL6523609 0.79 CYP2C19 (0.44) CYP19A1TDP1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL6516003 0.79 CYP2C19 (0.44) CYP19A1TDP1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL9247105 0.79 CYP19A1 (0.41) CYP19A1HCAR2ALDH1A1SMN1; SMN2HTT

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 CYP19A1 2315/4885HCAR2 3143/4885TDP1 1789/4885

“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.