SCHEMBL20567951

SCHEMBL20567951

CCS(=O)(=O)c1cc(O)cnc1-c1nc2cc(C(F)(F)F)nnc2n1C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
LRRK2 Q5S007 1/20 0.32
USP1 O94782 1/20 0.31
RORC P51449 1/20 0.30
KCNH2 Q12809 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
SCHEMBL17688763 0.88 PTGS2 (0.32) POLBLRRK2USP1KCNH2
SCHEMBL21761790 0.87 RORC (0.31) POLBLRRK2RORC
SCHEMBL21750096 0.87 EGLN1 (0.37) POLBLRRK2USP1RORC
SCHEMBL21750111 0.86 USP1 (0.33) POLBLRRK2USP1RORC
SCHEMBL22912032 0.86 LRRK2 (0.36) LRRK2USP1
SCHEMBL21761767 0.85 RORC (0.32) USP1RORC
SCHEMBL20553672 0.85 ELANE (0.34) LRRK2RORC
SCHEMBL22912035 0.85 RORC (0.33) POLBRORC
SCHEMBL20547490 0.84 CNR2 (0.33) LRRK2RORCKCNH2
SCHEMBL30958294 0.84 CNR2 (0.33) LRRK2RORCKCNH2

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
WO-2018215304-A1 TETRACYCLIC PYRIDAZINE SULPHUR CONTAINING COMPOUNDS AND THEIR USE AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2018-11-29 WO disclosed