SCHEMBL8167586

SCHEMBL8167586

Cc1c(NCc2ccccc2OCc2ccccc2)cccc1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGER1 P34995 1/20 0.59
▸ TDP1 Q9NUW8 4/20 0.53
▸ L3MBTL1 Q9Y468 4/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ GAA P10253 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ EDNRA P25101 1/20 0.49
▸ BRD4 O60885 1/20 0.49
▸ CTSV O60911 2/20 0.48
▸ CTSL P07711 2/20 0.48
▸ SGMS2 Q8NHU3 1/20 0.48
▸ MAPK1 P28482 1/20 0.48

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
SCHEMBL8167588 0.83 LMNA (0.53) PTGER1TDP1L3MBTL1MEN1KMT2A
SCHEMBL9054578 0.83 KDM4E (0.55) TDP1L3MBTL1MEN1KMT2AGAA
SCHEMBL410077 0.80 PTGER1 (0.76) PTGER1TDP1L3MBTL1MAPTEDNRA
SCHEMBL5778363 0.79 GAA (0.56) PTGER1TDP1L3MBTL1MEN1KMT2A
SCHEMBL6358805 0.76 SGMS2 (0.61) PTGER1TDP1L3MBTL1GAAMAPT
SCHEMBL8697604 0.75 USP28 (0.59) PTGER1LMNAALDH1A1CTSVCTSL
SCHEMBL5305401 0.75 LMNA (0.60) PTGER1TDP1L3MBTL1MEN1KMT2A
SCHEMBL27428219 0.75 GAA (0.50) PTGER1TDP1L3MBTL1MEN1KMT2A
SCHEMBL4345493 0.74 GAA (0.60) TDP1L3MBTL1MEN1KMT2AGAA
SCHEMBL4355825 0.74 MAPT (0.60) TDP1L3MBTL1MEN1KMT2AGAA

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
EP-0773930-B1 AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS ZENECA LTD (GB) 2000-10-11 — — EP disclosed
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