SCHEMBL8679646

SCHEMBL8679646

OCC/C=C\Cc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.68
TOP1 P11387 1/20 0.56
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
ARG2 P78540 1/20 0.52
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 2/20 0.44
KCNH2 Q12809 2/20 0.38
MGLL Q99685 1/20 0.36
GPR52 Q9Y2T5 2/20 0.36
CALM1 P0DP23 1/20 0.36
MAPK1 P28482 1/20 0.36
THRB P10828 1/20 0.34
IDO1 P14902 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34

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
SCHEMBL7590267 1.00 MAOB (0.68) MAOBTOP1CA1CA2ARG2
SCHEMBL15540038 1.00 MAOB (0.68) MAOBTOP1CA1CA2ARG2
SCHEMBL155054 0.83 MAOB (1.00) MAOBTOP1CA1CA2ARG2
SCHEMBL1524697 0.83 MAOB (1.00) MAOBTOP1CA1CA2ARG2
SCHEMBL155055 0.83 MAOB (1.00) MAOBTOP1CA1CA2ARG2
SCHEMBL8554597 0.82 TDP1 (0.58) TDP1TSHRGPR52
SCHEMBL8554601 0.82 TDP1 (0.58) TDP1TSHRGPR52
SCHEMBL221307 0.81 MAOB (0.75) MAOBTOP1CA1CA2ARG2
SCHEMBL16291705 0.81 MAOB (0.75) MAOBTOP1CA1CA2ARG2
SCHEMBL221306 0.81 MAOB (0.75) MAOBTOP1CA1CA2ARG2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756114-A INCLUDING A PESTICIDE THAT IS TOXIC TO A TERMITE'S GUT-DWELLING CELLULASE-PRODUCING PROTOZOA PETERSON JAMES E (US) 1998-05-26 US claimed
US-5756114-A INCLUDING A PESTICIDE THAT IS TOXIC TO A TERMITE'S GUT-DWELLING CELLULASE-PRODUCING PROTOZOA PETERSON JAMES E (US) 1998-05-26 US disclosed