SCHEMBL4884975

SCHEMBL4884975

CCOc1cc(F)c(F)c(B(c2c(F)c(F)cc(OCC)c2F)c2c(F)c(F)cc(OCC)c2F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
KDM1A O60341 2/20 0.35
LMNA P02545 1/20 0.33
TUBB1 Q9H4B7 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 2/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 2/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL18879525 0.81 L3MBTL1 (0.42) HTTL3MBTL1KDM1ALMNATUBB1
SCHEMBL4885889 0.78 L3MBTL1 (0.42) HTTL3MBTL1KDM1ALMNATUBB1
SCHEMBL30215998 0.78 TUBB1 (0.39) HTTKDM1ALMNATUBB1TDP1
SCHEMBL4878712 0.78 TUBB1 (0.39) HTTKDM1ALMNATUBB1TDP1
SCHEMBL4881695 0.77 GRIN2D (0.33) L3MBTL1TUBB1TSHR
SCHEMBL12300322 0.74 L3MBTL1 (0.40) HTTL3MBTL1KDM1ATUBB1CYP1A2
SCHEMBL4882871 0.73 L3MBTL1 (0.37) HTTL3MBTL1KDM1ALMNATUBB1
SCHEMBL2212304 0.72 L3MBTL1 (0.39) HTTL3MBTL1KDM1ATUBB1CYP1A2
SCHEMBL619866 0.71 CA1 (0.36)
SCHEMBL30524427 0.71 L3MBTL1 (0.38) HTTL3MBTL1KDM1ALMNATUBB1

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
EP-1817318-B1 STABILIZING METHOD AND STABILIZED COMPOSITION FOR ARYL BORON COMPOUNDS NIPPON CATALYTIC CHEM IND (JP) 2013-08-28 EP disclosed
US-20080154065-A1 Stabilizing Method and Stabilized Composition for Aryl Boron Compounds NIPPON SHOKUBAI CO., LTD. (JP) 2008-06-26 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-20080154065-A1 Stabilizing Method and Stabilized Composition for Aryl Boron Compounds AR, AHR, BCL6 HTT 445/4885L3MBTL1 2660/4885KDM1A 476/4885

“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.