SCHEMBL7040602

SCHEMBL7040602

C=C(CC(=O)OC(C(=O)OC)C1CCCC1)C(=O)OC(C(=O)OC)C1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
THRB P10828 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 4/20 0.33
NPSR1 Q6W5P4 3/20 0.33
SLC6A3 Q01959 2/20 0.33
EPHX1 P07099 1/20 0.33
EPHX2 P34913 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GAA P10253 1/20 0.30

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
SCHEMBL7040600 0.88 THRB (0.34) KMT2AMEN1THRBTP53TSHR
SCHEMBL24383740 0.78 TP53 (0.40) KMT2AMEN1THRBTP53TSHR
SCHEMBL7040782 0.76 TAAR1 (0.40) KMT2AMEN1TP53TSHRALDH1A1
SCHEMBL3858382 0.75 ALDH1A1 (0.33) KMT2AMEN1ALDH1A1NPSR1EPHX1
SCHEMBL22615669 0.70 CASP1 (0.34) KMT2AMEN1TSHRALDH1A1NPSR1
SCHEMBL22615974 0.70 CASP1 (0.34) KMT2AMEN1TSHRALDH1A1NPSR1
SCHEMBL22615799 0.70 CASP1 (0.34) KMT2AMEN1TSHRALDH1A1NPSR1
SCHEMBL22615461 0.70 CASP1 (0.34) KMT2AMEN1TSHRALDH1A1NPSR1
SCHEMBL18022827 0.70 TP53 (0.46) KMT2AMEN1THRBTP53TSHR
SCHEMBL16863975 0.70 TP53 (0.46) KMT2AMEN1THRBTP53TSHR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 KMT2A 1067/4885MEN1 3248/4885THRB 3136/4885

“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.