SCHEMBL17877959

SCHEMBL17877959

OBOc1ccc(N(c2ccccc2)c2ccc(B(O)O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.50
CA1 P00915 5/20 0.50
ENPP2 Q13822 4/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
MGLL Q99685 2/20 0.41
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL26464629 0.92 CA1 (0.55) CA2CA1ENPP2CA4CA6
SCHEMBL14926316 0.89 ALDH1A1 (0.45) CA2CA1ALDH1A1L3MBTL1KDM4E
SCHEMBL25982194 0.84 L3MBTL1 (0.41) CA2CA1MGLLALDH1A1L3MBTL1
SCHEMBL8974204 0.84 CA2 (0.54) CA2CA1ENPP2CA4CA6
SCHEMBL14806752 0.83 ALDH1A1 (0.39) CA2CA1MGLLALDH1A1L3MBTL1
SCHEMBL4234167 0.82 ENPP2 (0.62) CA2CA1ENPP2CA4CA6
SCHEMBL23966 0.82 ENPP2 (0.62) CA2CA1ENPP2CA4CA6
SCHEMBL18776353 0.81 NPC1 (0.38) CA2CA1MGLLALDH1A1L3MBTL1
SCHEMBL12872048 0.81 NPC1 (0.38) CA2CA1MGLLALDH1A1L3MBTL1
SCHEMBL19214440 0.81 CA2 (0.42) CA2CA1ENPP2MGLLKDM4E

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-9985217-B2 Material for organic electroluminescent device and organic electroluminescent device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-29 US disclosed
US-20160190468-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 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-20160190468-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME L1CAM, ODC1, OR10J3 CA2 3852/4885CA1 2635/4885ENPP2 3361/4885

“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.