SCHEMBL6525857

SCHEMBL6525857

C=C(CC(=O)Oc1ccccc1)C(=O)OCC(=O)CCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.38
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
MAPT P10636 5/20 0.36
ALDH1A1 P00352 4/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 2/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
BCL9 O00512 1/20 0.36
CTNNB1 P35222 1/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP19A1 P11511 1/20 0.35

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
SCHEMBL6518819 0.90 ZDHHC2 (0.42) PRSS1PRSS2PRSS3KMT2ASMN1; SMN2
SCHEMBL6517377 0.84 CYP19A1 (0.41) ELANEPRSS1PRSS2PRSS3MAPT
SCHEMBL6515990 0.84 CYP19A1 (0.46) ALDH1A1KMT2AMEN1HPGDSMN1; SMN2
SCHEMBL6520261 0.83 ELANE (0.40) ELANEPRSS1PRSS2PRSS3MAPT
SCHEMBL6515808 0.83 KMT2A (0.44) ELANEPRSS1PRSS2PRSS3MAPT
SCHEMBL6520262 0.81 ALDH1A1 (0.44) ELANEPRSS1PRSS2PRSS3MAPT
SCHEMBL6522455 0.80 CYP19A1 (0.40) ELANEPRSS1PRSS2PRSS3MAPT
SCHEMBL6520858 0.80 GAA (0.47) MAPTALDH1A1LMNANPC1POLB
SCHEMBL6523115 0.80 GAA (0.47) MAPTALDH1A1LMNANPC1POLB
SCHEMBL6835003 0.80 ELANE (0.47) ELANEPRSS1PRSS2PRSS3MAPT

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 ELANE 185/4885PRSS1 4433/4885PRSS2 4669/4885

“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.