SCHEMBL6522589

SCHEMBL6522589

C=C(CC(=O)OC(C)c1ccccc1)C(=O)OCC(=O)OCCOCCCC

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
RECQL P46063 1/20 0.38
GPR88 Q9GZN0 2/20 0.37
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
RARB P10826 1/20 0.35
HPGD P15428 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 2/20 0.35
EPHX2 P34913 1/20 0.35
FAAH O00519 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL6521140 0.86 KMT2A (0.40) SMN1; SMN2L3MBTL1KDM4EEPHX2
SCHEMBL6513820 0.81 HCAR2 (0.41) TSHRSMN1; SMN2LMNAL3MBTL1KDM4E
SCHEMBL6515096 0.81 TSHR (0.46) TSHRRECQLNPC1RAB9ALMNA
SCHEMBL6522180 0.80 NLRP3 (0.41) SMN1; SMN2LMNAL3MBTL1
SCHEMBL6516142 0.79 TSHR (0.41) TSHRRECQLNPC1RAB9ASMN1; SMN2
SCHEMBL6519432 0.79 FAAH (0.39) TSHRLMNARARBHPGDL3MBTL1
SCHEMBL6515076 0.79 DGKA (0.38) TSHRLMNARARBHPGDEPHX2
SCHEMBL6518926 0.79 FAAH (0.48) TSHRRECQLLMNAFAAH
SCHEMBL6520700 0.77 TDP1 (0.44) TSHRRECQLNPC1RAB9ALMNA
SCHEMBL8812407 0.77 HCAR2 (0.46) TSHRHPGDKDM4E

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 3581/4885RECQL 2058/4885GPR88 2251/4885

“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.