SCHEMBL4474816

SCHEMBL4474816

CCCCCc1ccc(C(=O)O)c(N)c1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.68
KAT8 Q9H7Z6 2/20 0.63
PPARG P37231 1/20 0.62
RARB P10826 8/20 0.57
RARA P10276 2/20 0.57
RARG P13631 1/20 0.57
ALDH1A1 P00352 2/20 0.51
PLK1 P53350 5/20 0.51
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
MTOR P42345 1/20 0.50
KMT2A Q03164 1/20 0.50
PLK3 Q9H4B4 1/20 0.49

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
SCHEMBL27568950 0.98 PPARA (0.70) PPARAKAT8PPARGRARBRARA
SCHEMBL2075723 0.98 PPARA (0.70) PPARAKAT8PPARGRARBRARA
SCHEMBL2077145 0.95 PPARA (0.60) PPARAKAT8PPARGRARBRARA
SCHEMBL27553918 0.88 PPARA (0.51) PPARAKAT8PPARGRARBRARA
SCHEMBL6756727 0.87 PPARA (0.52) PPARAKAT8PPARGRARBRARA
SCHEMBL10801712 0.86 KAT8 (0.70) PPARAKAT8PPARGRARBRARA
SCHEMBL2076751 0.86 KAT8 (0.70) PPARAKAT8PPARGRARBRARA
SCHEMBL12394303 0.85 MAOB (0.52) PPARAKAT8PPARGRARBRARA
SCHEMBL3033028 0.85 KAT8 (0.73) PPARAKAT8PPARGRARBRARA
SCHEMBL25173858 0.84 ALDH1A1 (0.55) PPARAKAT8PPARGALDH1A1MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6495247-B1 A COORDINATE BOND BEING A MULTIDENTATE BOND WHERE A MOLECULE BONDS WITH METALLIC ATOM ON SURFACE AND THE METALLIC ATOM IS BETWEEN THE LIGAND ATOMS MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2002-12-17 US claimed
EP-0896876-B1 FUNCTIONAL MEMBER HAVING MOLECULAR FILM ON THE SURFACE AND PROCESS FOR THE PRODUCTION THEREOF PANASONIC CORP (JP) 2009-01-21 EP disclosed
US-6495247-B1 A COORDINATE BOND BEING A MULTIDENTATE BOND WHERE A MOLECULE BONDS WITH METALLIC ATOM ON SURFACE AND THE METALLIC ATOM IS BETWEEN THE LIGAND ATOMS MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2002-12-17 US disclosed
EP-0896876-A1 FUNCTIONAL MEMBER HAVING MOLECULAR FILM ON THE SURFACE AND PROCESS FOR THE PRODUCTION THEREOF MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1999-02-17 EP disclosed