SCHEMBL7674397

SCHEMBL7674397

C#CCOc1ccc(CCNC(=O)C(NSC)c2ccc(F)cc2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ATM Q13315 1/20 0.46
LMNA P02545 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
ECE1 P42892 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL7676614 0.88 ALDH1A1 (0.44) KMT2AMEN1LMNACA12CA1
SCHEMBL6816280 0.86 KMT2A (0.49) KMT2AMEN1ATMLMNACA12
SCHEMBL6228302 0.84 KMT2A (0.48) KMT2AMEN1ATMLMNACA12
SCHEMBL6232313 0.84 KMT2A (0.48) KMT2AMEN1ATMLMNACA12
SCHEMBL3245973 0.82 KMT2A (0.49) KMT2AMEN1ATMLMNACA12
SCHEMBL3248887 0.82 KMT2A (0.49) KMT2AMEN1ATMLMNACA12
SCHEMBL3245967 0.82 KMT2A (0.49) KMT2AMEN1ATMLMNACA12
SCHEMBL1549195 0.81 KMT2A (0.48) KMT2AMEN1ATMLMNACA12
SCHEMBL1548575 0.81 KMT2A (0.48) KMT2AMEN1ATMLMNACA12
SCHEMBL1548595 0.81 KMT2A (0.48) KMT2AMEN1ATMLMNACA12

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
US-6479550-B1 α-sulfenimino acid derivatives SYNGENTA CROP PROTECTION, INC. 2002-11-12 US claimed