SCHEMBL28166102

SCHEMBL28166102

O=[PH](Oc1cccc2c1-c1ccccc1-2)Oc1cccc2c1-c1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 1/20 0.40
MAPT P10636 6/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
USP2 O75604 1/20 0.39
DUSP3 P51452 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 3/20 0.37
PTPRC P08575 3/20 0.37
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 3/20 0.37
APAF1 O14727 2/20 0.37
HTT P42858 2/20 0.37
S100A4 P26447 2/20 0.37
POLB P06746 2/20 0.37
MAPK1 P28482 2/20 0.37
CES2 O00748 1/20 0.37

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
SCHEMBL1230961 0.79 HDAC4 (0.41) TOP1MAPTMEN1KMT2AKDM4E
SCHEMBL11587030 0.76
SCHEMBL2146501 0.76 TOP1 (0.39) TOP1MAPTMEN1KMT2AALDH1A1
SCHEMBL491473 0.75 CA1 (0.39) TOP1MAPTMEN1KMT2AALDH1A1
Formaldehyde SCHEMBL28708546 0.74 TOP1 (0.38) TOP1MAPTMEN1KMT2AALDH1A1
SCHEMBL16174455 0.73 CA1 (0.57) TOP1MAPTMEN1KMT2AALDH1A1
SCHEMBL5576493 0.73 CA1 (0.57) TOP1MAPTMEN1KMT2AALDH1A1
SCHEMBL11606642 0.72 TDP1 (0.44) ALDH1A1KDM4ETDP1LMNARAB9A
SCHEMBL27288773 0.72 TOP1 (0.37) TOP1MAPTMEN1KMT2AALDH1A1
SCHEMBL28078532 0.72 TOP1 (0.55) TOP1MAPTMEN1KMT2AALDH1A1

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
CN-107075262-A Composite materials with enhanced electrical conductivity and methods of making the same LG化学株式会社 2017-08-18 CN disclosed