SCHEMBL23457658

SCHEMBL23457658

C/C(=N\c1ccc(F)cc1F)c1cccc(/C(C)=N/c2ccc(F)cc2F)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
POLB P06746 2/20 0.36
ALOX12 P18054 1/20 0.36
NPC1 O15118 2/20 0.35
KDM4E B2RXH2 3/20 0.34
GAA P10253 2/20 0.34
HTT P42858 2/20 0.34
LMNA P02545 1/20 0.34
MPI P34949 1/20 0.34
AGTR1 P30556 1/20 0.34
RAB9A P51151 1/20 0.34
HTR1F P30939 2/20 0.34
MT-CO1 P00395 1/20 0.33
MT-CO2 P00403 1/20 0.33
EDNRA P25101 1/20 0.33
OPRM1 P35372 1/20 0.33

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
SCHEMBL23457659 1.00 ALDH1A1 (0.36) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL28376119 0.98 ALDH1A1 (0.35) ALDH1A1MAPTMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL38849 0.97 NPC1 (0.35) ALDH1A1MAPTMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL14761757 0.97 NPC1 (0.35) ALDH1A1MAPTMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL2577967 0.97 NPC1 (0.35) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL23457823 0.94 ALDH1A1 (0.34) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL15082907 0.83 NPC1 (0.33) MAPTMEN1KMT2ATDP1POLB
SCHEMBL15082901 0.82 NOS3 (0.38) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL2230306 0.81 NPC1 (0.38) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL2230303 0.81 NPC1 (0.38) ALDH1A1MAPTMEN1KMT2ATDP1

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
WO-2021110762-A1 POLYETHYLENE COMPOSITION FOR FILAMENTS OR FIBERS BASELL POLYOLEFINE GMBH (DE) 2021-06-10 WO disclosed