SCHEMBL6520732

SCHEMBL6520732

C=C(C(=O)O)C(CCOCCCC)(CC(=O)c1ccc(C)cc1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MMP1 P03956 1/20 0.35
TSHR P16473 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
PPARA Q07869 2/20 0.34
TTR P02766 1/20 0.34
CYP2C8 P10632 1/20 0.34
CHRM1 P11229 1/20 0.34
ADRA1A P35348 1/20 0.34
PPARG P37231 1/20 0.34
HTR2B P41595 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLCO1B3 Q9NPD5 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CISD1 Q9NZ45 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34

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
SCHEMBL6516136 0.91 TSHR (0.39) RARBMMP1TSHRPPARASMN1; SMN2
SCHEMBL6521050 0.90 NPC1 (0.36) TSHRCYP1A2CYP2C9PPARATTR
SCHEMBL6523793 0.86 KDM4E (0.38) RARBKDM4ETSHRCYP1A2CYP2C9
SCHEMBL6515218 0.80 POLB (0.40) KDM4ETSHRPPARASMN1; SMN2TDP1
SCHEMBL6515093 0.78 TSHR (0.44) RARBTSHRPPARARECQL
SCHEMBL6520709 0.76 ALDH1A1 (0.34) TSHRPPARAPPARGKMT2AMEN1
SCHEMBL6520697 0.76 HPGD (0.38) TSHRPPARGKMT2AMEN1NPC1
SCHEMBL6520627 0.75 GGPS1 (0.38) KDM4EPPARAPPARGKMT2AMEN1
SCHEMBL6514758 0.74 LMNA (0.36) TSHRPPARASMN1; SMN2TDP1KMT2A
SCHEMBL6514698 0.74 POLB (0.43) KDM4ETSHRPPARASMN1; SMN2TDP1

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 RARB 1177/4885KDM4E 329/4885MMP1 1425/4885

“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.