SCHEMBL7165503

SCHEMBL7165503

CCCCCOC1C=CC(OCCCCC)C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 6/20 0.47
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 3/20 0.33
MAPK1 P28482 2/20 0.33
RECQL P46063 2/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
EPHX2 P34913 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
BLM P54132 1/20 0.33
LMNA P02545 1/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 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
SCHEMBL11787564 0.86 GBA1 (0.48) GBA1ALDH1A1TDP1TSHRMAPK1
SCHEMBL11599116 0.86 GBA1 (0.48) GBA1ALDH1A1TDP1TSHRMAPK1
SCHEMBL6267772 0.86 GBA1 (0.48) GBA1ALDH1A1TDP1TSHRMAPK1
SCHEMBL6524160 0.77 GBA1 (0.47) GBA1ALDH1A1TDP1TSHRMAPK1
SCHEMBL7116764 0.77 MAPK1 (0.35) GBA1ALDH1A1TSHRMAPK1TP53
SCHEMBL7116761 0.77 MAPK1 (0.35) GBA1ALDH1A1TSHRMAPK1TP53
SCHEMBL7116766 0.77 MAPK1 (0.35) GBA1ALDH1A1TSHRMAPK1TP53
SCHEMBL6517051 0.76 GBA1 (0.50) GBA1ALDH1A1TDP1TSHRMAPK1
SCHEMBL6519035 0.76 GBA1 (0.50) GBA1ALDH1A1TDP1TSHRMAPK1
SCHEMBL6519598 0.76 GBA1 (0.50) GBA1ALDH1A1TDP1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915073-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ISOMERS OF TRICYCLIC COMPOUNDS TORAY INDUSTRIES (JP) 2003-08-13 EP claimed
US-6103914-A Method of producing optically active material of tricyclic compound TORAY INDUSTRIES, INC. (JP) 2000-08-15 US claimed
EP-0915073-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ISOMERS OF TRICYCLIC COMPOUNDS TORAY INDUSTRIES, INC. (JP) 1999-05-12 EP claimed
EP-0915073-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ISOMERS OF TRICYCLIC COMPOUNDS TORAY INDUSTRIES (JP) 2003-08-13 EP disclosed
US-6103914-A Method of producing optically active material of tricyclic compound TORAY INDUSTRIES, INC. (JP) 2000-08-15 US disclosed
EP-0915073-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ISOMERS OF TRICYCLIC COMPOUNDS TORAY INDUSTRIES, INC. (JP) 1999-05-12 EP disclosed