SCHEMBL18173904

SCHEMBL18173904

CCC(COC)Nc1nc(C)nc(Oc2c(Br)cc(C(C)=O)cc2OC)n1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CRHR1 P34998 7/20 0.36
TSHR P16473 1/20 0.34
APOBEC3A P31941 1/20 0.34
HTT P42858 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
LMNA P02545 3/20 0.33
HPGD P15428 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
MAPK1 P28482 1/20 0.32
NCOA1 Q15788 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
POLB P06746 1/20 0.32
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
SCHEMBL18173908 0.91 SMN1; SMN2 (0.33) SMN1; SMN2MAPTRAB9AL3MBTL1ALDH1A1
SCHEMBL18173916 0.85 CRHR1 (0.44) CRHR1
SCHEMBL18173910 0.79 CRHR1 (0.35) CRHR1
SCHEMBL18173905 0.77 CRHR1 (0.38) CRHR1
SCHEMBL6773376 0.75 CRHR1 (0.51) SMN1; SMN2MAPTRAB9AL3MBTL1ALDH1A1
SCHEMBL6775942 0.75 CRHR1 (0.42) SMN1; SMN2MAPTRAB9AL3MBTL1ALDH1A1
SCHEMBL6894983 0.74 SMN1; SMN2 (0.33) SMN1; SMN2MAPTRAB9AL3MBTL1ALDH1A1
SCHEMBL6780139 0.70 TSHR (0.40) SMN1; SMN2MAPTRAB9AALDH1A1CRHR1
SCHEMBL6774484 0.69 CRHR1 (0.45) SMN1; SMN2MAPTALDH1A1CRHR1TSHR
SCHEMBL6770805 0.69 HTT (0.39) SMN1; SMN2MAPTALDH1A1CRHR1TSHR

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