SCHEMBL9843189

SCHEMBL9843189

O=[PH2]OCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
HRH1 P35367 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49
CNR1 P21554 1/20 0.49
SIGMAR1 Q99720 2/20 0.48
NPC1 O15118 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL11278773 0.81 POLB (0.61) POLBTDP1HRH1HRH3CNR1
SCHEMBL7854933 0.79 POLB (0.62) POLBTDP1HRH1HRH3CNR1
SCHEMBL6036357 0.79 POLB (0.55) POLBTDP1HRH1HRH3CNR1
SCHEMBL17131153 0.79 POLB (0.58) POLBTDP1HRH1HRH3CNR1
SCHEMBL1725500 0.79 POLB (0.55) POLBTDP1HRH1HRH3CNR1
SCHEMBL11283425 0.78 CNR1 (0.55) POLBTDP1HRH1HRH3CNR1
Fosphenytoin SCHEMBL119417 0.77 POLB (0.52) POLBTDP1HRH1HRH3CNR1
SCHEMBL14484233 0.77 POLB (0.56) POLBTDP1HRH1HRH3CNR1
Fosphenytoin SCHEMBL94254 0.77 POLB (0.56) POLBTDP1HRH1HRH3CNR1
Fosphenytoin SCHEMBL20769774 0.77 POLB (0.56) POLBTDP1HRH1HRH3CNR1

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-4260769-A 5,5-Diphenylhydantoins INTERX RESEARCH CORPORATION (US) 1981-04-07 US claimed
EP-0427925-A2 Use of prophenytoin for preparing pharmaceutical preparations for treating stroke and cerebral ischemia WARNER-LAMBERT COMPANY (US) 1991-05-22 EP disclosed