SCHEMBL21021896

SCHEMBL21021896

C=C(Nc1ccc(Cl)c(/C(=N/N)NN)c1)C1C(c2cc(C)cc(Cl)c2)C1(C)Cl

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 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
SCHEMBL20076742 0.86 MEN1 (0.31) MEN1ALDH1A1RECQLKMT2A
SCHEMBL21021313 0.83 MEN1 (0.30) MEN1ALDH1A1KMT2A
SCHEMBL21022221 0.82 SLC9A1 (0.32) SLC9A1
SCHEMBL20076548 0.80 POLB (0.34) SLC9A1MEN1ALDH1A1RECQLKMT2A
SCHEMBL20076667 0.79 GSTO1 (0.31) MEN1ALDH1A1RECQLKMT2A
SCHEMBL20076454 0.79 MEN1 (0.31) MEN1ALDH1A1KMT2A
SCHEMBL21021465 0.79 MEN1 (0.34) SLC9A1MEN1ALDH1A1RECQLKMT2A
SCHEMBL21020662 0.79 MEN1 (0.31) MEN1ALDH1A1KMT2A
SCHEMBL21019825 0.78 KDM4E (0.34) MEN1ALDH1A1KMT2A
SCHEMBL20076427 0.78 NPC1 (0.38) MEN1ALDH1A1RECQLKMT2A

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