SCHEMBL7446154

SCHEMBL7446154

COc1cc(Cc2ccc(O)cc2-c2ccc(OCCN3CCCC3)cc2)ccc1CN1CCCC1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 13/20 0.70
ESR1 P03372 5/20 0.51
ESR2 Q92731 3/20 0.51
LTA4H P09960 2/20 0.49

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
SCHEMBL7446550 0.95 F2 (0.64) F2ESR1ESR2
SCHEMBL7346685 0.94 F2 (0.62) F2ESR1ESR2
SCHEMBL7438768 0.92 F2 (0.71) F2ESR1ESR2
SCHEMBL7444675 0.91 F2 (0.61) F2ESR1ESR2
SCHEMBL7448434 0.90 F2 (0.58) F2ESR1ESR2LTA4H
SCHEMBL6966769 0.89 F2 (0.58) F2ESR1ESR2
SCHEMBL7964914 0.89 F2 (0.58) F2ESR1LTA4H
SCHEMBL7446083 0.89 F2 (0.60) F2LTA4H
SCHEMBL7348546 0.88 F2 (0.57) F2
SCHEMBL7439386 0.88 F2 (0.67) F2ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002500618-A 2002-01-08 JP claimed
EP-0863755-A4 ANTITHROMBOTIC DIAMINES LILLY CO ELI (US) 1999-01-20 EP claimed
EP-0863755-A1 ANTITHROMBOTIC DIAMINES ELI LILLY AND COMPANY (US) 1998-09-16 EP claimed
WO-1997025033-A1 ANTITHROMBOTIC DIAMINES ELI LILLY AND COMPANY (US) 1997-07-17 WO claimed
EP-0863755-A4 ANTITHROMBOTIC DIAMINES LILLY CO ELI (US) 1999-01-20 EP disclosed
EP-0863755-A1 ANTITHROMBOTIC DIAMINES ELI LILLY AND COMPANY (US) 1998-09-16 EP disclosed
WO-1997025033-A1 ANTITHROMBOTIC DIAMINES ELI LILLY AND COMPANY (US) 1997-07-17 WO disclosed