SCHEMBL14614690

SCHEMBL14614690

CNC(C)c1cccc(-c2ccccc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ IRAK4 Q9NWZ3 1/20 0.47
▸ ASIC3 Q9UHC3 1/20 0.44
▸ TRPV3 Q8NET8 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CNR2 P34972 2/20 0.41
▸ CNR1 P21554 1/20 0.39
▸ ADORA1 P30542 4/20 0.37
▸ HTR1A P08908 1/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HTR7 P34969 1/20 0.36
▸ ADORA3 P0DMS8 3/20 0.36
▸ ADORA2A P29274 2/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ F11 P03951 1/20 0.35
▸ XDH P47989 1/20 0.35
▸ CHEK1 O14757 1/20 0.35

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
SCHEMBL14614579 0.84 MEN1 (0.50) MEN1RAB9AKMT2AIRAK4ASIC3
SCHEMBL21116000 0.82 IRAK4 (0.48) IRAK4TRPV3CNR2CNR1
SCHEMBL2609332 0.81 KMT2A (0.60) MEN1RAB9AKMT2AASIC3TRPV3
SCHEMBL15868176 0.80 IRAK4 (0.40) MEN1KMT2AIRAK4HTR2AALDH1A1
SCHEMBL12137374 0.78 MEN1 (0.56) MEN1RAB9AKMT2AIRAK4ASIC3
SCHEMBL14108546 0.78 KMT2A (0.56) MEN1RAB9AKMT2AASIC3TRPV3
SCHEMBL16768767 0.78 MEN1 (0.56) MEN1RAB9AKMT2AIRAK4ASIC3
SCHEMBL27651071 0.78 KMT2A (0.56) MEN1RAB9AKMT2AASIC3TRPV3
SCHEMBL15883189 0.78 KMT2A (0.43) MEN1RAB9AKMT2AIRAK4ASIC3
SCHEMBL15883118 0.77 KDM4E (0.41) MEN1RAB9AKMT2AIRAK4MAPT

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-1757591-A1 CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2007-02-28 — — EP disclosed
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