SCHEMBL7974701

SCHEMBL7974701

CCOC(=O)c1ccc(OCCC2CCC3=C(CC2)C(=O)C(OC)=C(OC)C3=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPT P10636 4/20 0.46
KMT2A Q03164 1/20 0.44
KCNH2 Q12809 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
STS P08842 1/20 0.41
TBXAS1 P24557 1/20 0.40
P2RX3 P56373 3/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL7974477 0.86 PKM (0.47) KMT2ARAB9A
SCHEMBL7974650 0.84 MGAT2 (0.42) L3MBTL1KMT2A
SCHEMBL7971449 0.84 MAOB (0.44) L3MBTL1TDP1MAPTRAB9A
SCHEMBL7977603 0.83 L3MBTL1 (0.47) L3MBTL1TDP1MAPTKMT2AKCNH2
SCHEMBL7974462 0.82 MAPT (0.47) L3MBTL1TDP1MAPTKMT2AKCNH2
SCHEMBL7974787 0.81 TEAD1 (0.45) RAB9A
SCHEMBL7961113 0.81 HPGD (0.42) KMT2A
SCHEMBL944258 0.80 TDP1 (0.51) L3MBTL1TDP1KCNH2HRH3
SCHEMBL7974962 0.80 MAOB (0.40) L3MBTL1TDP1RAB9A
SCHEMBL7961502 0.80 MAOB (0.40) KMT2AHRH3

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-6326369-B1 ALZHEIMER'S DISEASE TAKEDA CHEMICALS INDUSTRIES, LTD. (JP) 2001-12-04 US claimed
US-6326369-B1 ALZHEIMER'S DISEASE TAKEDA CHEMICALS INDUSTRIES, LTD. (JP) 2001-12-04 US disclosed