SCHEMBL10014799

SCHEMBL10014799

Cc1cc(N2COc3ccc(P(=O)(Oc4ccccc4)Oc4ccccc4)cc3C2)ccc1F

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
VDR P11473 1/20 0.32
NPC1 O15118 1/20 0.32
PKM P14618 1/20 0.32
RAB9A P51151 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
HIF1A Q16665 1/20 0.30

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
SCHEMBL10014787 0.91 TDP1 (0.36) TDP1L3MBTL1MAPTNPSR1HPGD
SCHEMBL10014797 0.83 ACACB (0.32) MAPTGAASMN1; SMN2CYP3A4CYP2D6
SCHEMBL13912134 0.75
SCHEMBL17460731 0.73 MAPT (0.42) L3MBTL1MAPTNPSR1VDRGAA
SCHEMBL10014788 0.73 MAPT (0.46) MAPTNPSR1GAASMN1; SMN2HPGD
SCHEMBL10014786 0.73 GAA (0.31) MAPTGAASMN1; SMN2CYP3A4CYP2D6
SCHEMBL17460732 0.72 GAA (0.31) MAPTGAASMN1; SMN2
SCHEMBL10311140 0.71 CYP3A4 (0.40) TDP1L3MBTL1MAPTNPSR1VDR
SCHEMBL10014789 0.68 CYP3A4 (0.41) TDP1MAPTNPSR1VDRNPC1
SCHEMBL10014798 0.68 TDP1 (0.35) TDP1L3MBTL1MAPTGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8192892-B2 Phosphorous containing benzoxazine-based monomer, polymer thereof, electrode for fuel cell including the same, electrolyte membrane for fuel cell including the same, and fuel cell employing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-06-05 US disclosed