SCHEMBL18775360

SCHEMBL18775360

O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1COCOP(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
NPC1 O15118 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HRH1 P35367 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
CNR1 P21554 1/20 0.43

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
Fosphenytoin SCHEMBL20769774 0.89 POLB (0.56) POLBTDP1NPC1MEN1KMT2A
Fosphenytoin SCHEMBL94254 0.89 POLB (0.56) POLBTDP1NPC1MEN1KMT2A
Fosphenytoin SCHEMBL1560790 0.88 POLB (0.55) POLBTDP1NPC1MEN1KMT2A
Fosphenytoin SCHEMBL318673 0.88 POLB (0.55) POLBTDP1NPC1MEN1KMT2A
Fosphenytoin SCHEMBL7205444 0.88 POLB (0.55) POLBTDP1NPC1MEN1KMT2A
Fosphenytoin SCHEMBL28132875 0.82 POLB (0.49) POLBTDP1NPC1MEN1KMT2A
SCHEMBL2615240 0.82 POLB (0.49) POLBTDP1NPC1MEN1KMT2A
Fosphenytoin SCHEMBL5798533 0.81 CYP2C9 (0.52) POLBTDP1NPC1MEN1KMT2A
SCHEMBL1725500 0.81 POLB (0.55) POLBTDP1NPC1MEN1KMT2A
SCHEMBL17131153 0.81 POLB (0.58) POLBTDP1NPC1MEN1KMT2A

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-20170112948-A1 Inorganic-organic hybrid compound Karlsruher Institut für Technologie (DE) 2017-04-27 US disclosed
US-20170112948-A1 Inorganic-organic hybrid compound Karlsruher Institut für Technologie (DE) 2017-04-27 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-20170112948-A1 Inorganic-organic hybrid compound SLCO4C1, SLCO2A1, SLCO1A2 POLB 3337/4885TDP1 3934/4885NPC1 277/4885

“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.