SCHEMBL21020692

SCHEMBL21020692

C=C(NC)c1cc(NC(=C)C2C(c3cc(C)cc(Cl)c3)C2(C)O)ccc1Cl

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 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
SCHEMBL21022183 0.86 RAB9A (0.41) MEN1ALDH1A1LMNAMAPTKMT2A
SCHEMBL21021128 0.85 NPC1 (0.31)
SCHEMBL21021342 0.80
SCHEMBL20076742 0.79 MEN1 (0.31) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL21021313 0.79 MEN1 (0.30) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL21021990 0.79 SMN1; SMN2 (0.33) MEN1ALDH1A1MAPTKMT2A
SCHEMBL21021736 0.78 KMT2A (0.38) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL21020721 0.77 SLC9A1 (0.36) MEN1ALDH1A1LMNAMAPTKMT2A
SCHEMBL21022022 0.76 MEN1 (0.32) MEN1ALDH1A1LMNAKMT2A
SCHEMBL20076436 0.76 SLC9A1 (0.36) 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