SCHEMBL7871392

SCHEMBL7871392

C=CCCCCc1ccc(Nc2ccccc2-c2cccc(C)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.37
PDE4D Q08499 2/20 0.37
HCAR2 Q8TDS4 1/20 0.36
FFAR1 O14842 2/20 0.35
FFAR4 Q5NUL3 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
CHRM3 P20309 5/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
PLA2G1B P04054 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 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
SCHEMBL7871347 0.84 HCAR2 (0.39) PDE4BHCAR2FFAR1FFAR4MEN1
SCHEMBL7871380 0.84 HCAR2 (0.37) HCAR2FFAR1FFAR4MEN1KMT2A
SCHEMBL7874942 0.82 HCAR2 (0.40) HCAR2FFAR1FFAR4MEN1KMT2A
SCHEMBL7877470 0.81 L3MBTL1 (0.46) PDE4BHCAR2FFAR1FFAR4MEN1
SCHEMBL7871397 0.81 FFAR1 (0.43) FFAR1FFAR4ALDH1A1NPSR1
SCHEMBL7877481 0.78 TDP1 (0.44) PDE4BPDE4DMEN1KMT2ANPC1
SCHEMBL130522 0.77 NPSR1 (0.46) MEN1KMT2ANPC1POLBRAB9A
SCHEMBL17246941 0.76 NPSR1 (0.56) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7716047 0.75 NPSR1 (0.41) MEN1KMT2ANPC1RAB9ACHRM3
SCHEMBL7717151 0.75 NPSR1 (0.41) MEN1KMT2ANPC1RAB9ACHRM3

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-20010017155-A1 Of monovinylated triarylamine monomers; use in light emitting diodes or as components of photorefractive materials CALIFORNIA INSTITUTE OF TECHNOLOGY 2001-08-30 US disclosed