SCHEMBL26314552

SCHEMBL26314552

OB(O)c1ccc(-c2ccc(B(O)O)cn2)nc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 6/20 0.42
CA2 P00918 4/20 0.40
CA1 P00915 3/20 0.40
LPL P06858 2/20 0.40
LIPG Q9Y5X9 2/20 0.40
TSHR P16473 1/20 0.40
CCR1 P32246 1/20 0.40
CCR5 P51681 1/20 0.40
CCR8 P51685 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
P4HA1 P13674 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
MGLL Q99685 2/20 0.37
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL38656446 1.00 ENPP2 (0.42) ENPP2CA2CA1LPLLIPG
SCHEMBL29698485 0.85 KDM4E (0.54) ENPP2CCR1CCR5CCR8P4HTM
SCHEMBL2597518 0.85 KDM4E (0.54) ENPP2CCR1CCR5CCR8P4HTM
SCHEMBL29950578 0.83 MGLL (0.54) ENPP2CA2CA1CA4CA6
SCHEMBL441703 0.83 MGLL (0.54) ENPP2CA2CA1CA4CA6
SCHEMBL28905531 0.81 KDR (0.46) ENPP2CA2CA1TSHRHDAC6
SCHEMBL2560337 0.80 NPC1 (0.53) CA2CA1MGLL
SCHEMBL14668828 0.80 CA2 (0.54) CA2CA1LPLLIPGCCR1
SCHEMBL30518373 0.80 NPC1 (0.53) CA2CA1MGLL
SCHEMBL19780935 0.80 ENPP2 (0.54) ENPP2CA2CA1MGLLKDM4E

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-20230263058-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2023-08-17 US disclosed
US-20230263058-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2023-08-17 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-20230263058-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT NR2E3, LGR4, NCOA4 ENPP2 2364/4885CA2 3559/4885CA1 3922/4885

“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.