SCHEMBL8099427

SCHEMBL8099427

CN1CSC(OC(=O)NC(C)(C)C)C(=O)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.33
KCNH2 Q12809 1/20 0.30
CACNA1I Q9P0X4 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
SCHEMBL8099316 0.86 TACR1 (0.33) TACR1
SCHEMBL8105898 0.78 EPHX2 (0.35)
SCHEMBL8097668 0.78 NR2E1 (0.32)
SCHEMBL2053916 0.78 MEN1 (0.38)
SCHEMBL8788621 0.77 ACACB (0.36) KCNH2
SCHEMBL8102941 0.76 MAPT (0.36)
SCHEMBL8105676 0.75 ADRB1 (0.33) TACR1
SCHEMBL8787230 0.75 NTMT1 (0.33)
SCHEMBL9272668 0.73 CYP17A1 (0.32)
SCHEMBL8105919 0.73 FFAR4 (0.34)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672038-B1 HERBICIDES ZENECA LTD (GB) 2000-01-19 EP disclosed
US-5856273-A CONTROLLING WEEDS ZENECA LIMITED (GB) 1999-01-05 US disclosed
EP-0672038-A1 HERBICIDES ZENECA LIMITED (GB) 1995-09-20 EP disclosed
WO-1994013652-A1 HERBICIDES ZENECA LIMITED (GB) 1994-06-23 WO disclosed