SCHEMBL9446239

SCHEMBL9446239

NC(=O)c1oncc1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
KDM6B O15054 1/20 0.34
KDM4A O75164 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32

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
SCHEMBL9593260 0.87 SIRT3 (0.35) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL5611024 0.85 ALDH1A1 (0.35) ALDH1A1KDM4EKMT2AMEN1KDM6B
SCHEMBL31519448 0.76
Valine SCHEMBL9381375 0.75 SLC7A5 (0.46) L3MBTL1
SCHEMBL6332334 0.74
SCHEMBL9446195 0.73 ERN1 (0.32)
SCHEMBL12967744 0.72
SCHEMBL31299641 0.72 CYP2C9 (0.46) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL439222 0.70
SCHEMBL20928810 0.70

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
US-5205854-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1993-04-27 US disclosed
US-5080708-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1992-01-14 US disclosed