SCHEMBL9862053

SCHEMBL9862053

CC(=O)Oc1ccc(-c2ccccc2)c(Oc2ccccc2)c1OC(C)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 5/20 0.55
▸ ADORA3 P0DMS8 4/20 0.52
▸ ADORA2A P29274 2/20 0.52
▸ ADORA1 P30542 2/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ LMNA P02545 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ HPGD P15428 2/20 0.52
▸ GAA P10253 1/20 0.52
▸ MPI P34949 1/20 0.52
▸ TDP1 Q9NUW8 2/20 0.50
▸ POLB P06746 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ RECQL P46063 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ MAPK1 P28482 1/20 0.45
▸ PDE4A P27815 1/20 0.43
▸ PDE4B Q07343 1/20 0.43

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
SCHEMBL27325002 0.80 ADORA3 (0.56) BACE1ADORA3ADORA2AADORA1KDM4E
SCHEMBL8676657 0.80 MAPK1 (0.60) BACE1ADORA3ADORA2AADORA1KDM4E
SCHEMBL11660889 0.79 ADORA3 (0.54) BACE1ADORA3ADORA2AADORA1KDM4E
SCHEMBL10596845 0.77 MAPK1 (0.57) BACE1ADORA3ADORA2AADORA1KDM4E
SCHEMBL10434956 0.76 MAPK1 (0.60) BACE1KDM4ELMNAMAPTSMN1; SMN2
SCHEMBL11550677 0.76 LTA4H (0.42) BACE1ADORA2AKDM4EMAPTALDH1A1
SCHEMBL9862048 0.75 BACE1 (0.56) BACE1ADORA3ADORA2AADORA1KDM4E
SCHEMBL11894598 0.75 LMNA (0.54) ADORA3ADORA2AADORA1KDM4ELMNA
SCHEMBL27559161 0.74 BACE1 (0.58) BACE1ADORA3ADORA2AADORA1KDM4E
SCHEMBL8587292 0.74 MAPK1 (0.53) BACE1ADORA3ADORA2AADORA1KDM4E

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
EP-0410929-A2 Linear polymers CIBA-GEIGY AG (CH) 1991-01-30 — — EP claimed
EP-0410929-A2 Linear polymers CIBA-GEIGY AG (CH) 1991-01-30 — — EP disclosed
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