SCHEMBL21020672

SCHEMBL21020672

C=C(Nc1ccc(Cl)c(-c2ccc(Cl)c(C)c2)c1)C1C(c2cc(C)cc(C)c2)C1(C)Cl

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
USP28 Q96RU2 1/20 0.31
ABL1 P00519 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
SCHEMBL21020662 0.87 MEN1 (0.31) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL21022268 0.86 IL2 (0.30)
SCHEMBL21021036 0.84 USP28 (0.31) MEN1LMNAMAPTKMT2AUSP28
SCHEMBL21021283 0.82
SCHEMBL20076427 0.81 NPC1 (0.38) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL21020695 0.81
SCHEMBL21021594 0.81 POLB (0.37) MEN1ALDH1A1GAAMAPTKMT2A
SCHEMBL21020810 0.80 LMNA (0.36) MEN1LMNAMAPTKMT2AUSP28
SCHEMBL21022129 0.80 NPC1 (0.34) LMNAMAPTUSP28
SCHEMBL21021127 0.77 SLC9A1 (0.33) MEN1ALDH1A1LMNAGAAMAPT

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