SCHEMBL9632663

SCHEMBL9632663

[N-]=[N+]=C1C=C(P(=O)(O)O)C(Nc2ccccc2)=CC1

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
HTT P42858 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
ALDH1A1 P00352 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
CASP3 P42574 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SENP8 Q96LD8 1/20 0.31

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
SCHEMBL9633633 0.81 SRC (0.34) ALDH1A1
SCHEMBL8925475 0.78 MAP2K7 (0.34) NPC1LMNAMAPTHTTRAB9A
SCHEMBL9633545 0.77 S1PR2 (0.36)
SCHEMBL9633559 0.73 CA12 (0.31) CA12CA9
SCHEMBL9634644 0.73
SCHEMBL9632677 0.68
SCHEMBL9632817 0.65 KMT2A (0.38) NPC1LMNAMAPTRAB9ASMN1; SMN2
SCHEMBL3080719 0.64 HSD17B10 (0.37) MAPTHTTL3MBTL1ALDH1A1MAPK1
SCHEMBL9633556 0.63 CA2 (0.33)
SCHEMBL9633301 0.62 SRC (0.37) ALDH1A1

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
EP-0487343-A1 Process for preparing a lithographic plate Fuji Photo Film Co., Ltd. (JP) 1992-05-27 EP disclosed