SCHEMBL9727365

SCHEMBL9727365

C#CCN1C(=O)COc2cc(F)c(NC(=O)OCC)cc21

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
CHRM1 P11229 1/20 0.40
PLK1 P53350 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL9031064 0.91 POLB (0.44) POLBHTTCHRM1PLK1TSHR
SCHEMBL9478444 0.88 CHRM1 (0.37) POLBHTTUSP2CHRM1L3MBTL1
SCHEMBL9478449 0.88 CHRM1 (0.37) POLBHTTUSP2CHRM1L3MBTL1
SCHEMBL9224359 0.86 POLB (0.43) POLBHTTCHRM1PLK1TSHR
SCHEMBL10844388 0.86 POLB (0.38) POLBHTTUSP2CHRM1L3MBTL1
SCHEMBL7687650 0.83 CHRM1 (0.40) POLBCHRM1TSHR
SCHEMBL9345399 0.83 POLB (0.37) POLBCHRM1PLK1
SCHEMBL9228447 0.82 POLB (0.44) POLBCHRM1PLK1TSHRALDH1A1
SCHEMBL1802016 0.82 ALDH1A1 (0.37) ALDH1A1HPGDHSD17B10
SCHEMBL9477612 0.82 POLB (0.35) POLBHTTUSP2CHRM1L3MBTL1

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
US-5127935-A Halogen, phenyl and heterocycle substituents, agricultural use NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-07-07 US disclosed
US-5084084-A Uracil and thiouracil derivatives NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-01-28 US disclosed
EP-0408382-A2 Uracil derivatives and herbicides containing the same as active ingredient NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1991-01-16 EP disclosed