SCHEMBL8694178

SCHEMBL8694178

Cn1nc(C(F)(F)F)cc1Oc1cccc(COc2cccc(Cl)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
TGFBR1 P36897 2/20 0.38
FFAR1 O14842 1/20 0.38
MAOB P27338 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HTR2C P28335 2/20 0.37
SLC6A4 P31645 1/20 0.37
HTR2B P41595 1/20 0.37
PPARG P37231 2/20 0.37
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
HTR7 P34969 1/20 0.36
HTR6 P50406 1/20 0.36
MRGPRX4 Q96LA9 2/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL8693775 0.91 KMT2A (0.43) KMT2AADORA2AADORA1TGFBR1FFAR1
SCHEMBL8696729 0.90 GRM5 (0.41) KMT2AADORA2AADORA1FFAR1MAOB
SCHEMBL8692231 0.89 ADORA2A (0.40) KMT2AADORA2AADORA1TGFBR1MAOB
SCHEMBL8693809 0.89 KMT2A (0.43) KMT2AADORA2AADORA1MAOBALDH1A1
SCHEMBL8785419 0.88 KMT2A (0.41) KMT2AADORA2AADORA1TGFBR1MAOB
SCHEMBL8629274 0.87 KMT2A (0.46) KMT2AADORA2AADORA1TGFBR1MAOB
SCHEMBL8784535 0.86 ADORA2A (0.41) KMT2AADORA2AADORA1TGFBR1MAOB
SCHEMBL8692599 0.85 ADORA2A (0.41) KMT2AADORA2AADORA1TGFBR1MAOB
SCHEMBL8695612 0.85 MAPT (0.41) KMT2AADORA2AADORA1TGFBR1FFAR1
SCHEMBL8694286 0.84 KMT2A (0.45) KMT2AADORA2AADORA1TGFBR1FFAR1

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
US-5807804-A CONTROLLING WEEDS AMERICAN CYANAMID COMPANY (US) 1998-09-15 US claimed