SCHEMBL6289070

SCHEMBL6289070

COC(=O)c1ccc(CC(=O)N(Cc2ccc(C(=O)OC)c(OCc3ccccc3)c2)OC(C)(C)C)cc1OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.45
ALOX5 P09917 3/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
APP P05067 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
LTB4R Q15722 2/20 0.39
LTB4R2 Q9NPC1 2/20 0.39
RAF1 P04049 1/20 0.38
MAP2K1 Q02750 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38

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
SCHEMBL6289072 0.80 HDAC3 (0.50) FFAR4MEN1KMT2AAPPLMNA
SCHEMBL14892610 0.80 FFAR4 (0.59) FFAR4LMNAHPGDMTNR1AMTNR1B
SCHEMBL4699386 0.76 FFAR4 (0.57) FFAR4LMNAHPGDMTNR1AMTNR1B
SCHEMBL2773150 0.76 FFAR4 (0.57) FFAR4LMNAHPGDMTNR1AMTNR1B
Hydrochloric Acid SCHEMBL6289049 0.74 FFAR4 (0.55) FFAR4MEN1KMT2ALMNAHPGD
SCHEMBL3962253 0.73 MAOB (0.61) FFAR4MEN1KMT2ALMNAHPGD
SCHEMBL11557673 0.72 KDM4E (0.60) FFAR4MEN1KMT2AAPPLMNA
SCHEMBL7907439 0.72 MAOB (0.56) FFAR4
SCHEMBL14891403 0.71 FFAR4 (0.54) FFAR4LMNAHPGD
SCHEMBL16491109 0.71 FFAR4 (0.54) FFAR4LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6870065-B2 Bifunctional boronic compound complexing reagents and complexes CAMBREX BIO SCIENCE ROCKLAND, INC. (US) 2005-03-22 US disclosed
US-20030105280-A1 Bifunctional boronic compound complexing reagents and complexes AHLEM CLARENCE N (US) 2003-06-05 US disclosed
US-6414122-B1 BIOCHEMICAL CONJUGATION TO PROTEINS, PEPTIDES, HORMONES, POLYSACCHARIDES, NUCLEIC ACIDS, LIPOSOMES, RADIONUCLIDES, HAPTENS, AND TOXINS PROLINX, INC. 2002-07-02 US disclosed
US-6156884-A Bifunctional boronic compound complexing reagents and complexes PROLINX, INC. (US) 2000-12-05 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-20030105280-A1 Bifunctional boronic compound complexing reagents and complexes CHN2, CFH, COG2 FFAR4 4382/4885ALOX5 3133/4885MEN1 182/4885

“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.