SCHEMBL28708338

SCHEMBL28708338

NSCCOc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.58
TAAR1 Q96RJ0 1/20 0.58
LTA4H P09960 4/20 0.55
PLA2G2A P14555 1/20 0.55
ALDH1A1 P00352 2/20 0.52
RECQL P46063 1/20 0.52
NPC1 O15118 1/20 0.51
LMNA P02545 1/20 0.51
RAB9A P51151 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CHRNB2 P17787 2/20 0.48
CHRNB4 P30926 2/20 0.48
CHRNA3 P32297 2/20 0.48
CHRNA7 P36544 2/20 0.48
CHRNA4 P43681 2/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47

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
SCHEMBL8671561 0.81 KCNA3 (0.64) KCNA3TAAR1LTA4HPLA2G2AALDH1A1
SCHEMBL14499849 0.81 KCNA3 (0.64) KCNA3TAAR1LTA4HPLA2G2AALDH1A1
SCHEMBL11300555 0.79 KCNA3 (0.61) KCNA3TAAR1LTA4HPLA2G2AALDH1A1
SCHEMBL11285757 0.77 KCNA3 (0.58) KCNA3TAAR1LTA4HALDH1A1RECQL
SCHEMBL19542483 0.77 KCNA3 (0.58) KCNA3TAAR1LTA4HPLA2G2AALDH1A1
SCHEMBL27515353 0.77 KCNA3 (0.58) KCNA3TAAR1LTA4HPLA2G2AALDH1A1
SCHEMBL9808023 0.77 ALDH1A1 (0.61) KCNA3TAAR1ALDH1A1RECQLNPC1
SCHEMBL27962 0.77 KCNA3 (0.82) KCNA3TAAR1LTA4HPLA2G2AALDH1A1
SCHEMBL23733022 0.77 RAB9A (0.62) ALDH1A1LMNARAB9AL3MBTL1MEN1
SCHEMBL10873329 0.75 PKM (0.50) KCNA3TAAR1LTA4HPLA2G2AALDH1A1

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-114144062-A Pesticidal formulations 石原产业株式会社 2022-03-04 CN disclosed