SCHEMBL9892559

SCHEMBL9892559

O=C1C=CCON1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.42
ALDH1A1 P00352 3/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP1A2 P05177 1/20 0.38
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
LMNA P02545 1/20 0.35
AKR1C3 P42330 2/20 0.35
FAAH O00519 3/20 0.34
HSP90AA1 P07900 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
GAA P10253 2/20 0.32
GSK3A P49840 2/20 0.32
GSK3B P49841 2/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL19901335 0.72 NPC1 (0.44) MGLLALDH1A1MEN1KMT2ANPC1
SCHEMBL5898761 0.66 LMNA (0.45) ALDH1A1MEN1KMT2ALMNAPKM
SCHEMBL5898762 0.66 LMNA (0.45) ALDH1A1MEN1KMT2ALMNAPKM
SCHEMBL1111106 0.65 MEN1 (0.50) MGLLALDH1A1MEN1KMT2ANPC1
SCHEMBL24776903 0.65 MGLL (0.44) MGLLALDH1A1CYP2C9CYP2C19CYP1A2
SCHEMBL8305439 0.64
SCHEMBL11574008 0.64 ALDH1A1 (0.40) MGLLALDH1A1CYP2C9CYP2C19CYP1A2
SCHEMBL4185086 0.64 MEN1 (0.43) ALDH1A1CYP2C9CYP2C19CYP1A2MEN1
SCHEMBL8526316 0.63 MGLL (0.59) MGLLALDH1A1MEN1KMT2AFAAH
SCHEMBL10656286 0.63 LMNA (0.35) CYP2C9CYP2C19MEN1KMT2ANPC1

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-20120138345-A1 ADHESIVE COMPOSITION, ADHESIVE FILM AND WIRING FILM USING THE SAME HITACHI CABLE, LTD. 2012-06-07 US disclosed