SCHEMBL8438519

SCHEMBL8438519

COc1nc(OC)nc(N(C)C(=O)NS(=O)(=O)c2ccccc2OC(F)(F)F)n1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALPL P05186 2/20 0.43
SLC40A1 Q9NP59 1/20 0.42
FBP1 P09467 1/20 0.39
PTGER4 P35408 1/20 0.38
KCNK3 O14649 1/20 0.38
KCNK9 Q9NPC2 1/20 0.38
SLC22A12 Q96S37 3/20 0.38
MRGPRX1 Q96LB2 1/20 0.38
AXL P30530 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
BRD4 O60885 1/20 0.36
KAT6A Q92794 1/20 0.35
ABCC9 O60706 1/20 0.35
ABCC8 Q09428 1/20 0.35
KCNJ11 Q14654 1/20 0.35
KCNJ8 Q15842 1/20 0.35
HTR6 P50406 1/20 0.35
GSTO1 P78417 1/20 0.35

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
SCHEMBL10694204 0.94 ALPL (0.40) ALPLSLC40A1FBP1PTGER4KCNK3
SCHEMBL10688266 0.88 ALPL (0.44) ALPLSLC40A1FBP1PTGER4KCNK3
SCHEMBL8441174 0.85 MEN1 (0.36) SLC40A1SLC22A12MEN1KMT2AKAT6A
SCHEMBL10890810 0.84 KMT2A (0.40) MEN1KMT2A
SCHEMBL10875513 0.82 MEN1 (0.36) MEN1KMT2A
SCHEMBL10749633 0.82 MEN1 (0.40) MEN1KMT2A
SCHEMBL10695682 0.81 MAPT (0.46) ALPLSLC40A1FBP1PTGER4KCNK3
SCHEMBL11064642 0.81 MEN1 (0.53) MEN1KMT2A
SCHEMBL10504586 0.81 MEN1 (0.42) MEN1KMT2A
SCHEMBL10875959 0.80 MEN1 (0.38) MEN1KMT2AKAT6A

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-4780126-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1988-10-25 US claimed
US-5886176-A Process for preparing sulphonylurea salts BAYER AKTIENGESELLSCHAFT (DE) 1999-03-23 US disclosed
US-5328896-A Preparing herbicidal sulphonylurea salts BAYER AKTIENGESELLSCHAFT (DE) 1994-07-12 US disclosed