SCHEMBL8303961

SCHEMBL8303961

CCOC(Cc1ccc(CCCN2CCN(Cc3ccccc3)CCC2=O)cc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 5/20 0.51
LMNA P02545 6/20 0.50
MEN1 O00255 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
KMT2A Q03164 2/20 0.50
THRB P10828 2/20 0.49
MAPT P10636 2/20 0.49
PPARG P37231 3/20 0.48
PPARA Q07869 3/20 0.48
RECQL P46063 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
SCHEMBL8302764 0.93 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2LMNAMEN1NPC1
SCHEMBL8304487 0.86 PPARG (0.48) PPARGPPARA
SCHEMBL8302026 0.80 SLC6A2 (0.39) ALDH1A1SMN1; SMN2LMNAMEN1NPC1
SCHEMBL8306093 0.77 PPARG (0.39) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL8300947 0.73 PPARG (0.59) PPARGPPARA
SCHEMBL8302884 0.73 PPARG (0.62) PPARGPPARA
SCHEMBL4993002 0.71 PPARA (0.69) PPARGPPARA
SCHEMBL1670312 0.71 PPARA (0.69) PPARGPPARA
SCHEMBL7533363 0.71 PPARG (0.73) PPARGPPARA
SCHEMBL7532542 0.71 PPARA (0.72) PPARGPPARA

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