SCHEMBL8867397

SCHEMBL8867397

COc1ccc(C(C)C[O])cc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.54
CA2 P00918 2/20 0.54
CA1 P00915 1/20 0.54
POLB P06746 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
PPARG P37231 1/20 0.50
PPARD Q03181 1/20 0.50
PPARA Q07869 1/20 0.50
KMT2A Q03164 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
ALOX12 P18054 1/20 0.47

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
SCHEMBL8298141 0.84 ALDH1A1 (0.60) ACHECA2CA1PPARGPPARD
SCHEMBL1024752 0.81 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL1022684 0.81 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL6774889 0.81 CA2 (0.50) ACHECA2CA1POLBTSHR
SCHEMBL14032605 0.81 ACHE (0.50) ACHECA2CA1POLBTSHR
SCHEMBL8867400 0.81 PPARG (0.64) ACHECA2CA1TSHRPPARG
SCHEMBL29959275 0.81 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL3654988 0.81 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL7873221 0.80 ACHE (0.50) ACHECA2CA1POLBTSHR
SCHEMBL18679866 0.80 ACHE (0.50) ACHECA2CA1POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 US disclosed