SCHEMBL11252191

SCHEMBL11252191

COc1ccc(-n2cc(C#N)c(=O)[nH]c2=O)c(C)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.67
GAA P10253 2/20 0.48
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
GLA P06280 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
HTR3A P46098 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
DRD1 P21728 1/20 0.38
IDH1 O75874 2/20 0.38
METAP2 P50579 1/20 0.38
SRD5A1 P18405 1/20 0.38
ESRRA P11474 1/20 0.37
ESR2 Q92731 1/20 0.37

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
SCHEMBL11249668 0.88 L3MBTL1 (0.67) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11250834 0.84 GAA (0.52) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11243558 0.83 L3MBTL1 (0.64) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11253313 0.82 GAA (0.50) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11247286 0.82 KMT2A (0.51) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11246109 0.82 GAA (0.50) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11237396 0.80 L3MBTL1 (1.00) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11255920 0.80 L3MBTL1 (0.80) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11255788 0.80 L3MBTL1 (0.50) L3MBTL1GAAKMT2AMEN1KDM4E
SCHEMBL11250334 0.80 GAA (0.51) L3MBTL1GAAKMT2AMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4358591-A BACTERICIDES, FUNGICIDES; PLANT DISEASES ZOECON CORPORATION (US) 1982-11-09 US disclosed
US-4338318-A FUNGICIDE OR BACERICIDE TO TREAT PLANT DISEASES WITH A PHENYL URACIL ZOECON CORPORATION (US) 1982-07-06 US disclosed
US-4307098-A 2-PHENYL-URACIL COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-12-22 US disclosed
US-4297297-A α-Cyano-β-(substituted-anilino)-N-ethoxycarbonylacrylamide intermediates ZOECON CORP. (US) 1981-10-27 US disclosed
US-4266056-A FUNGICIDES, BACTERICIDES ZOECON CORPORATION (US) 1981-05-05 US disclosed