SCHEMBL10693785

SCHEMBL10693785

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTO1 P78417 1/20 0.41
ALPL P05186 1/20 0.38
KCNK3 O14649 1/20 0.37
KCNK9 Q9NPC2 1/20 0.37
SLC40A1 Q9NP59 1/20 0.37
ABCC9 O60706 1/20 0.37
ABCC8 Q09428 1/20 0.37
KCNJ11 Q14654 1/20 0.37
KCNJ8 Q15842 1/20 0.37
NAMPT P43490 2/20 0.35
MRGPRX1 Q96LB2 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
HTR6 P50406 1/20 0.35
KDM2B Q8NHM5 1/20 0.34
POLB P06746 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
AKR1C3 P42330 1/20 0.34

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
SCHEMBL10695682 0.81 MAPT (0.46) ALPLKCNK3KCNK9SLC40A1ABCC9
SCHEMBL10508336 0.80 CA1 (0.46) SLC40A1MEN1KMT2AMAPTPOLB
SCHEMBL8438519 0.77 ALPL (0.43) GSTO1ALPLKCNK3KCNK9SLC40A1
SCHEMBL19417683 0.77 PTK2 (0.36) MEN1KMT2AMAPTPOLB
SCHEMBL13881366 0.75 PTK2 (0.35) GSTO1MEN1KMT2AMAPTHTT
SCHEMBL10692208 0.75 MAPT (0.43) ALPLSLC40A1NAMPTMRGPRX1MAPT
SCHEMBL11067484 0.75 TSHR (0.47) ALPLMEN1KMT2AMAPT
SCHEMBL9737078 0.74 ALPL (0.40) ALPLSLC40A1NAMPTMRGPRX1MAPT
SCHEMBL9735723 0.74 MRGPRX1 (0.38) GSTO1ALPLSLC40A1NAMPTMRGPRX1
SCHEMBL9589357 0.73 MEN1 (0.36) ALPLSLC40A1MRGPRX1MEN1KMT2A

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-4780126-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1988-10-25 US claimed