SCHEMBL11420987

SCHEMBL11420987

O=C1NC(=O)c2cc(Cl)c(Cl)c3c(Cl)ccc1c23

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPOX P50336 1/20 0.46
▸ CES1 P23141 5/20 0.42
▸ PARP1 P09874 2/20 0.38
▸ MAOA P21397 2/20 0.38
▸ MAOB P27338 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ PKM P14618 2/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ RGS12 O14924 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ CASP1 P29466 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
SCHEMBL6796386 0.76 PPOX (0.45) PPOXCES1PARP1MAOAMAOB
SCHEMBL29716114 0.74 PARP1 (0.59) PPOXPARP1MAOAMAOBNPSR1
SCHEMBL278438 0.74 PARP1 (0.59) PPOXPARP1MAOAMAOBNPSR1
SCHEMBL11634756 0.73 CES1 (0.52) PPOXCES1GSK3B
SCHEMBL10484576 0.73 PPOX (0.53) PPOXCES1PARP1MAOAMAOB
SCHEMBL13578768 0.72 PPOX (0.47) PPOXCES1PARP1MAOAMAOB
SCHEMBL8726186 0.72 PARP1 (0.56) PPOXPARP1MAOAMAOBNPSR1
SCHEMBL11341934 0.71 CES1 (0.46) PPOXCES1PARP1USP2CASP1
SCHEMBL13129894 0.71 PPOX (0.41) PPOXCES1PARP1MAOAMAOB
SCHEMBL1413190 0.70 PPOX (0.58) PPOXCES1MAOAMAOBNPSR1

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-4181530-A ELECTRON ATTRACTING PHTHALIMIDE FUJI PHOTO FILM CO., LTD. (JP) 1980-01-01 — — US claimed
US-4181530-A ELECTRON ATTRACTING PHTHALIMIDE FUJI PHOTO FILM CO., LTD. (JP) 1980-01-01 — — US disclosed
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