SCHEMBL6521052

SCHEMBL6521052

O=C(CCc1ccccc1)CC(C(=O)O)=C(C(=O)O)C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
CYP2C19 P33261 1/20 0.54
TAAR1 Q96RJ0 1/20 0.48
EPHX2 P34913 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
ALOX12 P18054 1/20 0.45
RECQL P46063 1/20 0.45
EPHX1 P07099 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
MMP12 P39900 1/20 0.42
CCR5 P51681 1/20 0.42
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL6521038 1.00 ALDH1A1 (0.54) ALDH1A1CYP2C19TAAR1EPHX2SMN1; SMN2
SCHEMBL6517301 0.85 EPHX2 (0.48) ALDH1A1CYP2C19TAAR1EPHX2LMNA
SCHEMBL6517293 0.85 EPHX2 (0.48) ALDH1A1CYP2C19TAAR1EPHX2LMNA
SCHEMBL6519872 0.82 ALDH1A1 (0.52) ALDH1A1CYP2C19TAAR1EPHX2SMN1; SMN2
SCHEMBL9404055 0.81 ALDH1A1 (0.61) ALDH1A1CYP2C19TAAR1EPHX2SMN1; SMN2
SCHEMBL9709177 0.80 EPHX2 (0.51) ALDH1A1CYP2C19TAAR1EPHX2SMN1; SMN2
SCHEMBL9709173 0.80 EPHX2 (0.51) ALDH1A1CYP2C19TAAR1EPHX2SMN1; SMN2
SCHEMBL10193611 0.78 EPHX2 (0.49) ALDH1A1CYP2C19TAAR1EPHX2LMNA
SCHEMBL6520832 0.77 ERCC5 (0.50) TAAR1EPHX2SMN1; SMN2LMNAKDM4E
SCHEMBL6520836 0.77 ERCC5 (0.50) TAAR1EPHX2SMN1; SMN2LMNAKDM4E

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 1254/4885CYP2C19 2771/4885TAAR1 1161/4885

“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.