SCHEMBL21021767

SCHEMBL21021767

CCc1ccc(C2C(c3ccc(CC(C)(C)F)c(Cl)c3)C2(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
NLRP1 Q9C000 1/20 0.34
SLC5A2 P31639 4/20 0.32
SLC9A1 P19634 1/20 0.32
SLC5A1 P13866 2/20 0.31

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
SCHEMBL21022303 0.76 KDM1A (0.33) SLC9A1
SCHEMBL21021613 0.75 SLC9A1 (0.34) LMNASLC5A2SLC9A1SLC5A1
SCHEMBL21021537 0.73 ALOX5 (0.41) LMNAMAPK1NLRP1SLC5A2
SCHEMBL21020916 0.70 KDM1A (0.46) LMNA
SCHEMBL20076684 0.70 SLC9A1 (0.38) SLC5A2SLC9A1SLC5A1
SCHEMBL21021588 0.66 SLC5A2 (0.35) SLC5A2SLC9A1SLC5A1
SCHEMBL24159946 0.64 MAPK1 (0.39) LMNAMAPK1NLRP1
SCHEMBL21021657 0.63 KDM1A (0.41)
SCHEMBL21020918 0.63 SLC5A2 (0.35) LMNAMAPK1NLRP1SLC5A2SLC9A1
SCHEMBL21022090 0.62 CNR2 (0.40) MAPK1SLC5A2SLC9A1SLC5A1

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
EP-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed