SCHEMBL10862580

SCHEMBL10862580

CCOC(=O)C(=CNC1CC1)C(=O)c1ccccc1S(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.41
▸ DHODH Q02127 3/20 0.41
▸ GAA P10253 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ BCAT2 O15382 1/20 0.38
▸ LMNA P02545 3/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ CYP2D6 P10635 2/20 0.37
▸ TSHR P16473 2/20 0.36
▸ PLIN1 O60240 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ PLIN5 Q00G26 1/20 0.36
▸ ABHD5 Q8WTS1 1/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35

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
SCHEMBL9306236 0.82 KDM4E (0.43) MAPTDHODHGAATDP1MEN1
SCHEMBL10375594 0.82 USP2 (0.46) MAPTDHODHGAATDP1MEN1
SCHEMBL10863678 0.81 MEN1 (0.51) MAPTDHODHGAATDP1MEN1
SCHEMBL10628848 0.81 ALDH1A1 (0.50) MAPTDHODHGAATDP1MEN1
SCHEMBL10628854 0.81 ALDH1A1 (0.50) MAPTDHODHGAATDP1MEN1
SCHEMBL10862684 0.81 LMNA (0.46) MAPTDHODHGAATDP1MEN1
SCHEMBL10863359 0.80 ALDH1A1 (0.47) MAPTDHODHGAATDP1KMT2A
SCHEMBL10862944 0.78 MEN1 (0.46) MAPTDHODHGAATDP1MEN1
SCHEMBL4958597 0.77 MAPT (0.44) MAPTDHODHGAATDP1MEN1
SCHEMBL4958601 0.77 MAPT (0.44) MAPTDHODHGAATDP1MEN1

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-0168733-A2 Process for the preparation of quinolinone and naphthyridoncarboxylic acids BAYER AG (DE) 1986-01-22 — — EP disclosed
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