SCHEMBL10879741

SCHEMBL10879741

COCc1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(COC)cc3)c3ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.46
FFAR1 O14842 7/20 0.43
L3MBTL1 Q9Y468 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
ATM Q13315 2/20 0.40
GRM5 P41594 1/20 0.38
APP P05067 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL10942753 0.85 FFAR1 (0.36) ACACBFFAR1L3MBTL1TDP1ATM
SCHEMBL10941479 0.84 NAAA (0.37) ACACBFFAR1L3MBTL1TDP1ATM
SCHEMBL10880914 0.78 L3MBTL1 (0.40) ACACBL3MBTL1TDP1ATM
SCHEMBL10946361 0.78 FFAR1 (0.38) ACACBFFAR1L3MBTL1TDP1ATM
SCHEMBL10881132 0.77 FFAR1 (0.34) ACACBFFAR1L3MBTL1TDP1ATM
SCHEMBL10881663 0.76 ALOX15 (0.35) FFAR1L3MBTL1TDP1ATMFFAR4
SCHEMBL10944992 0.76 L3MBTL1 (0.39) ACACBL3MBTL1TDP1ATMAPP
SCHEMBL31332275 0.76 L3MBTL1 (0.60) ACACBL3MBTL1TDP1ATMAPP
SCHEMBL19122229 0.75 ACACB (0.47) ACACBFFAR1GRM5APP
SCHEMBL11028593 0.74 FFAR1 (0.46) FFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0107008-B1 9,10-BIS(PHENYLETHYNYL)-ANTHRACENES AMERICAN CYANAMID COMPANY (US) 1986-03-26 EP claimed
EP-0107008-A1 9,10-bis(phenylethynyl)-anthracenes AMERICAN CYANAMID COMPANY (US) 1984-05-02 EP claimed
EP-0107008-B1 9,10-BIS(PHENYLETHYNYL)-ANTHRACENES AMERICAN CYANAMID COMPANY (US) 1986-03-26 EP disclosed