SCHEMBL8538137

SCHEMBL8538137

C[C](C)Oc1cccc(-c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
EPHX1 P07099 1/20 0.47
FABP7 O15540 1/20 0.47
FABP3 P05413 1/20 0.47
FABP5 Q01469 1/20 0.47
FAAH O00519 1/20 0.46
ALOX5 P09917 1/20 0.46

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
SCHEMBL4446422 0.84 MAPT (0.67) MAPTTDP1RXRARXRBEPHX1
SCHEMBL12469524 0.81 RXRA (0.51) MAPTTDP1RXRARXRBEPHX1
SCHEMBL8540453 0.80 MAPT (0.49) MAPTTDP1FABP7FABP3FABP5
Trimethylammonium SCHEMBL27796894 0.80 MAPT (0.61) MAPTTDP1RXRARXRBEPHX1
SCHEMBL95954 0.79 CA4 (0.48) MAPTTDP1
SCHEMBL4260925 0.79 EPHX1 (0.55) MAPTTDP1RXRARXRBEPHX1
SCHEMBL29053641 0.79 EPHX1 (0.55) RXRARXRBEPHX1FABP7FABP3
SCHEMBL28032593 0.79 LMNA (0.66) MAPTTDP1RXRARXRB
SCHEMBL30833342 0.78 ELANE (0.55) MAPTTDP1RXRARXRBEPHX1
SCHEMBL16820804 0.78 ELANE (0.55) MAPTTDP1RXRARXRBEPHX1

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-5719155-A CARDIOVASCULAR DISORDERS JAPAN TOBACCO INC. (JP) 1998-02-17 US disclosed
EP-0677519-A1 CHROMAN DERIVATIVE AND MEDICINAL USE THEREOF Japan Tobacco Inc. (JP) 1995-10-18 EP disclosed