SCHEMBL23712440

SCHEMBL23712440

CO/C=C(\C)Oc1cc(COc2ccccc2)ccc1C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.44
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MAOB P27338 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
APP P05067 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
F10 P00742 1/20 0.38

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
SCHEMBL23712382 0.86 FFAR1 (0.42) FFAR1MAOB
SCHEMBL23712456 0.85 RAB9A (0.43) FFAR1RAB9AMAOBALDH1A1MAPT
SCHEMBL26418764 0.83 FFAR1 (0.44) FFAR1CTDSP1TDP1NPC1RAB9A
SCHEMBL23712641 0.82 LTA4H (0.40) TDP1MEN1KMT2ALMNAALDH1A1
SCHEMBL23712386 0.81 ATM (0.40) FFAR1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL23712495 0.78 LTA4H (0.41) TDP1NPC1RAB9AMEN1KMT2A
SCHEMBL26419875 0.78 FFAR1 (0.46) FFAR1CTDSP1TDP1RAB9AMEN1
SCHEMBL23712388 0.77 PKM (0.38) TDP1MEN1KMT2AALDH1A1MAPT
SCHEMBL23712502 0.73 LTB4R (0.38) FFAR1LMNA
SCHEMBL23712783 0.73 LMNA (0.44) FFAR1CTDSP1TDP1MEN1KMT2A

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-2021153782-A1 METHOD FOR CONTROLLING PHAKOPSORA PACHYRHIZI HAVING RESISTANCE AGAINST QoI FUNGICIDE 住友化学株式会社 2021-08-05 WO disclosed