SCHEMBL11215085

SCHEMBL11215085

C=CC/C=C/CCCC.C=CCC=CCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.50
TOP1 P11387 1/20 0.49
KCNH2 Q12809 2/20 0.47
EPHX2 P34913 5/20 0.43
FAAH O00519 2/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
ARG2 P78540 1/20 0.37

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
SCHEMBL11215081 1.00 MAOB (0.50) MAOBTOP1KCNH2EPHX2FAAH
SCHEMBL11215091 1.00 MAOB (0.50) MAOBTOP1KCNH2EPHX2FAAH
SCHEMBL19031833 0.89 MAOB (0.62) MAOBTOP1KCNH2EPHX2FAAH
SCHEMBL19031834 0.89 MAOB (0.62) MAOBTOP1KCNH2EPHX2FAAH
SCHEMBL19031836 0.84 MAOB (0.60) MAOBTOP1KCNH2EPHX2FAAH
SCHEMBL19031835 0.84 MAOB (0.60) MAOBTOP1KCNH2EPHX2FAAH
SCHEMBL8074750 0.84 MAOB (0.71) MAOBTOP1KCNH2CNR2CA1
SCHEMBL8074747 0.84 MAOB (0.71) MAOBTOP1KCNH2CNR2CA1
SCHEMBL17027720 0.82 KCNH2 (0.59) MAOBTOP1KCNH2EPHX2FAAH
SCHEMBL19031851 0.82 KCNH2 (0.59) MAOBTOP1KCNH2EPHX2FAAH

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-4400488-A ADDING BUTENE POLYMER THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-08-23 US disclosed