SCHEMBL8649253

SCHEMBL8649253

COC(=O)Cc1ccccc1COc1ccccc1C

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.49
▸ RXRB P28702 1/20 0.49
▸ RXRG P48443 1/20 0.49
▸ TDP1 Q9NUW8 3/20 0.48
▸ MAPT P10636 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ RECQL P46063 1/20 0.47
▸ POLB P06746 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ NOTUM Q6P988 1/20 0.46
▸ PTGDR2 Q9Y5Y4 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ SMN1; SMN2 Q16637 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
SCHEMBL18749637 0.86 MRGPRX4 (0.49) TDP1MAPTPOLBTSHRL3MBTL1
SCHEMBL28334171 0.86 SMN1; SMN2 (0.52) TDP1MAPTPOLBTSHRALDH1A1
SCHEMBL18749771 0.85 MAPT (0.44) MAPTNPSR1RECQLALDH1A1PTGDR2
SCHEMBL4114001 0.84 RXRA (0.55) RXRARXRBRXRGNPSR1RECQL
SCHEMBL8467383 0.84 TDP1 (0.43) RXRARXRBRXRGTDP1MAPT
SCHEMBL7174468 0.84 TP53 (0.58) RXRARXRBMAPTNPSR1TSHR
SCHEMBL18515095 0.83 FFAR4 (0.50) MAPTALDH1A1
SCHEMBL18749543 0.82 LMNA (0.44) MAPTPTGDR2LMNA
SCHEMBL18749540 0.82 PARP10 (0.39) TDP1MAPTL3MBTL1ALDH1A1PTGDR2
SCHEMBL18514413 0.82 PTGDR2 (0.40) MAPTNPSR1ALDH1A1PTGDR2

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
US-5710314-A FUNGICIDES OR INSECTICIDES OF AROMATIC ETHERS WITH ESTER GROUPS OR AMIDES NOVARTIS CORPORATION (US) 1998-01-20 — — US disclosed
EP-0784606-A1 MICROBICIDES Novartis AG (CH) 1997-07-23 — — EP disclosed
WO-1996010556-A1 MICROBICIDES NOVARTIS AG (CH) 1996-04-11 — — WO disclosed
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