SCHEMBL18173908

SCHEMBL18173908

C=C(C)c1cc(Br)c(Oc2nc(C)nc(NC(CC)COC)n2)c(OC)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CRHR1 P34998 6/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.30
APOBEC3A P31941 1/20 0.30
HTT P42858 1/20 0.30
APOBEC3G Q9HC16 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
SCHEMBL18173904 0.91 SMN1; SMN2 (0.37) SMN1; SMN2MAPTRAB9AL3MBTL1CRHR1
SCHEMBL18173916 0.85 CRHR1 (0.44) CRHR1
SCHEMBL18173910 0.84 CRHR1 (0.35) CRHR1
SCHEMBL6894983 0.83 SMN1; SMN2 (0.33) SMN1; SMN2MAPTRAB9AL3MBTL1ALDH1A1
SCHEMBL18173905 0.77 CRHR1 (0.38) CRHR1
SCHEMBL6780634 0.75 CRHR1 (0.45) SMN1; SMN2MAPTRAB9AL3MBTL1CRHR1
SCHEMBL6777461 0.75 CRHR1 (0.39) SMN1; SMN2MAPTRAB9AL3MBTL1CRHR1
SCHEMBL6775111 0.71 CRHR1 (0.41) SMN1; SMN2CRHR1ALDH1A1
SCHEMBL6770815 0.71 KMT2A (0.39) SMN1; SMN2MAPTCRHR1ALDH1A1TSHR
SCHEMBL6770576 0.70 KMT2A (0.39) SMN1; SMN2MAPTRAB9ACRHR1ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3286170-A1 PHENOXY- OR PYRIDIN-2-YLOXY-AMINOTRIAZINE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2018-02-28 EP claimed
WO-2016169831-A1 PHENOXY- OR PYRIDIN-2-YLOXY-AMINOTRIAZINE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2016-10-27 WO claimed
EP-3286170-A1 PHENOXY- OR PYRIDIN-2-YLOXY-AMINOTRIAZINE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2018-02-28 EP disclosed
WO-2016169831-A1 PHENOXY- OR PYRIDIN-2-YLOXY-AMINOTRIAZINE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2016-10-27 WO disclosed