SCHEMBL6955247

SCHEMBL6955247

COC(Cc1ccc(OCCN2CN(C)c3ccc(C)cc3C2=O)cc1)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.44
ALDH1A1 P00352 6/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
LMNA P02545 4/20 0.44
POLB P06746 2/20 0.44
RCE1 Q9Y256 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TP53 P04637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
PPARG P37231 11/20 0.37
PPARA Q07869 10/20 0.37
PPARD Q03181 3/20 0.37

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
SCHEMBL6956130 0.80 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL8302577 0.75 PPARG (0.41) PPARGPPARAPPARD
SCHEMBL6952500 0.74 PPARA (0.46) PPARGPPARAPPARD
SCHEMBL6947127 0.74 ALDH1A1 (0.40) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL6948555 0.74 PPARG (0.43) POLBTDP1PPARGPPARAPPARD
SCHEMBL6947132 0.72 ALDH1A1 (0.41) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL6956393 0.71 PPARA (0.37) POLBTDP1PPARGPPARA
SCHEMBL6957295 0.71 PPARG (0.41) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL6952324 0.71 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL7111403 0.70 PPARG (0.52) MAPTALDH1A1KMT2AMEN1POLB

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-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed