SCHEMBL6525899

SCHEMBL6525899

C=C(C(=O)O)C(C(=O)O)(C(C)C(=O)OCCCCCCCC)C(C)C(=O)OCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
NAAA Q02083 1/20 0.41
HCAR2 Q8TDS4 2/20 0.40
EPHX1 P07099 1/20 0.39
RAD52 P43351 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
FAAH O00519 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
ACHE P22303 4/20 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
SCHEMBL6513669 1.00 TSHR (0.45) TSHRNAAAHCAR2EPHX1RAD52
SCHEMBL6520567 0.94 ALDH1A1 (0.39) TSHRNAAAHCAR2EPHX1NPSR1
SCHEMBL6514768 0.86 TSHR (0.36) TSHRHCAR2ALDH1A1
SCHEMBL6520315 0.82 THRB (0.33)
SCHEMBL6518789 0.81 ALDH1A1 (0.32) TSHRALDH1A1LMNA
SCHEMBL6515845 0.81 THRB (0.44) TSHRALDH1A1
SCHEMBL6524297 0.80 TSHR (0.31) TSHR
SCHEMBL8889848 0.76 NAAA (0.47) TSHRNAAAHCAR2EPHX1RAD52
Hydrochloric Acid SCHEMBL8889340 0.75 NAAA (0.46) TSHRNAAAHCAR2EPHX1RAD52
SCHEMBL13998853 0.74 NAAA (0.52) TSHRNAAAHCAR2EPHX1RAD52

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 TSHR 3581/4885NAAA 2110/4885HCAR2 3143/4885

“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.