SCHEMBL7657807

SCHEMBL7657807

CCN(CC)C(=O)n1cnc(S(=O)(=O)C(F)(F)Br)n1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.38
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.32
MLYCD O95822 1/20 0.31
HTR1A P08908 1/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
PTBP1 P26599 1/20 0.30
P2RX1 P51575 1/20 0.30
P2RX3 P56373 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
P2RX4 Q99571 1/20 0.30
P2RX7 Q99572 1/20 0.30

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
SCHEMBL7664112 0.84 DPP4 (0.35) DPP4TDP1LMNAALDH1A1
SCHEMBL9544526 0.82 DPP4 (0.40) DPP4APOBEC3AAPOBEC3GTDP1LMNA
SCHEMBL7670473 0.82 DPP4 (0.43) DPP4
SCHEMBL9542985 0.82 DPP4 (0.42) DPP4APOBEC3AAPOBEC3GTDP1LMNA
SCHEMBL7660189 0.81 DPP4 (0.34) DPP4
SCHEMBL9015551 0.80 DPP4 (0.40) DPP4APOBEC3AAPOBEC3GTDP1LMNA
SCHEMBL9492135 0.79 DPP4 (0.35) DPP4
SCHEMBL7667992 0.79 DPP4 (0.41) DPP4APOBEC3AAPOBEC3GTDP1LMNA
SCHEMBL11561239 0.78 DPP4 (0.40) DPP4APOBEC3AAPOBEC3GTDP1LMNA
SCHEMBL11561748 0.78 DPP4 (0.40) DPP4APOBEC3AAPOBEC3GTDP1LMNA

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-6461997-B1 SUCH AS 3-(BROMODIFLUOROMETHYLSULFONYL)-1-(N,N-DIETHYL-CARBAMOYL)-1,2,4-TRIAZOLE; SELECTIVITY FOR WEEDS OVER CROPS; APPLY TO PLANTS OR SOIL MONSANTO TECHNOLOGY LLC 2002-10-08 US disclosed
EP-1140865-A1 TRIAZOLE SULFONES HAVING HERBIDICIDAL ACTIVITY Monsanto Co. (US) 2001-10-10 EP disclosed
WO-2000042028-A1 TRIAZOLE SULFONES HAVING HERBICIDAL ACTIVITY MONSANTO TECHNOLOGY LLC (US) 2000-07-20 WO disclosed