SCHEMBL15310434

SCHEMBL15310434

CC1OC(C)(C)CN1C(=O)C(Cl)Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 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
SCHEMBL9508760 0.68 ALDH1A1 (0.37) MEN1ALDH1A1KMT2A
SCHEMBL7941934 0.67 SMN1; SMN2 (0.47) MEN1ALDH1A1KMT2A
SCHEMBL8429253 0.66 SMN1; SMN2 (0.34) MEN1ALDH1A1KMT2A
SCHEMBL8429251 0.66 SMN1; SMN2 (0.34) MEN1ALDH1A1KMT2A
SCHEMBL167473 0.66 SMN1; SMN2 (0.34) MEN1ALDH1A1KMT2A
SCHEMBL9509916 0.64
SCHEMBL3097587 0.64
SCHEMBL3432157 0.63
SCHEMBL3640945 0.62 MEN1 (0.30) MEN1ALDH1A1KMT2A
SCHEMBL9506387 0.61 SMN1; SMN2 (0.31)

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-2121639-B1 SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2013-10-16 EP disclosed