SCHEMBL7271189

SCHEMBL7271189

CCCC(=O)C(=Cc1cccc(OC)c1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
MAPT P10636 1/20 0.46
FOS P01100 1/20 0.46
JUN P05412 1/20 0.46
BCHE P06276 1/20 0.46
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
GLO1 Q04760 1/20 0.45
MTNR1B P49286 4/20 0.43
MAOB P27338 2/20 0.43
FBP1 P09467 1/20 0.43
MTNR1A P48039 3/20 0.42
NR1H4 Q96RI1 1/20 0.42

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
SCHEMBL7821956 0.85 MEN1 (0.68) ALDH1A1MEN1KMT2AMAPTFOS
SCHEMBL7821958 0.85 MEN1 (0.68) ALDH1A1MEN1KMT2AMAPTFOS
SCHEMBL28931550 0.83 AKR1C3 (0.47) ALDH1A1MAPTKDM4ELMNA
SCHEMBL9475106 0.81 MEN1 (0.62) ALDH1A1MEN1KMT2AMAPTFOS
SCHEMBL7421645 0.81 MEN1 (0.62) ALDH1A1MEN1KMT2AMAPTFOS
SCHEMBL7273129 0.81 MEN1 (0.54) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL11163967 0.80 GAA (0.60) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL3540130 0.78 ALOX5 (0.58) ALDH1A1MEN1KMT2AMAPTFOS
SCHEMBL10350421 0.78 MEN1 (0.51) ALDH1A1MEN1KMT2AMAPTFOS
SCHEMBL31483473 0.78 MEN1 (0.51) ALDH1A1MEN1KMT2AMAPTFOS

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
EP-0114273-B1 NEW PHARMACOLOGICALLY ACTIVE PYRAZOLOPYRIDINES GRUPPO LEPETIT S.p.A. (IT) 1991-11-06 EP disclosed
US-4954508-A HYPOTENSIVE GRUPPO LEPETIT S.P.A. (IT) 1990-09-04 US disclosed
EP-0114273-A1 New pharmacologically active pyrazolopyridines GRUPPO LEPETIT S.p.A. (IT) 1984-08-01 EP disclosed