Fosphenytoin

Fosphenytoin

SCHEMBL5798533

O=C1NC(=O)C(c2ccccc2)(c2ccccc2)N1.O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1COP(=O)(O)O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9A

The experimentally established mechanism targets of Fosphenytoin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A known ✓ P35498 1/20 0.52
SCN4A known ✓ P35499 1/20 0.52
SCN5A known ✓ Q14524 1/20 0.52
SCN2A known ✓ Q99250 1/20 0.52
SCN3A known ✓ Q9NY46 1/20 0.52
CYP2C9 P11712 2/20 0.52
HRH1 P35367 2/20 0.52
CACNA1F O60840 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
HTR2A P28223 1/20 0.52
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
CACNA1D Q01668 1/20 0.52
KCNH2 Q12809 1/20 0.52
CACNA1S Q13698 1/20 0.52
CACNA1C Q13936 1/20 0.52
AKR1B1 P15121 1/20 0.49
POLB P06746 2/20 0.48
TDP1 Q9NUW8 1/20 0.48

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 0.91 POLB (0.56) HRH1POLBTDP1NPC1MEN1
Fosphenytoin SCHEMBL94254 0.91 POLB (0.56) HRH1POLBTDP1NPC1MEN1
Fosphenytoin SCHEMBL1560790 0.90 POLB (0.55) HRH1POLBTDP1NPC1MEN1
Fosphenytoin SCHEMBL318673 0.90 POLB (0.55) HRH1POLBTDP1NPC1MEN1
Fosphenytoin SCHEMBL7205444 0.90 POLB (0.55) HRH1POLBTDP1NPC1MEN1
SCHEMBL2615240 0.84 POLB (0.49) POLBTDP1NPC1MEN1KMT2A
Fosphenytoin SCHEMBL28132875 0.84 POLB (0.49) HRH1POLBTDP1NPC1MEN1
SCHEMBL18775360 0.81 POLB (0.51) HRH1POLBTDP1NPC1MEN1
SCHEMBL1725500 0.81 POLB (0.55) HRH1POLBTDP1NPC1MEN1
SCHEMBL8056128 0.80 POLB (0.55) HRH1POLBTDP1NPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3027202-A1 DRUG DELIVERY METHOD Regents of the University of Minnesota (US) 2016-06-08 EP disclosed
WO-2015017715-A1 DRUG DELIVERY METHOD REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2015-02-05 WO disclosed
WO-2006060736-A2 A COMPOSITION AND USE THEREOF IN ENHANCING A THERAPEUTIC EFFECT OF AN ANTIEPILEPTIC DRUG THE CHILDREN'S HOSPITAL OF PHILADELPHIA (US) 2006-06-08 WO disclosed