SCHEMBL7769343

SCHEMBL7769343

CCCOc1cccc(C([NH])=O)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.73
NR1H4 Q96RI1 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.55
MAPT P10636 1/20 0.55
SMPD1 P17405 3/20 0.55
THRB P10828 2/20 0.54
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
KAT6A Q92794 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
PLA2G4B P0C869 1/20 0.51
ADRB2 P07550 1/20 0.51
ADRB1 P08588 1/20 0.51
ADRB3 P13945 1/20 0.51
THRA P10827 1/20 0.50
MEN1 O00255 1/20 0.50
PRSS1 P07477 1/20 0.50

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
SCHEMBL7765680 0.92 THRB (0.63) KMT2ANR1H4SMPD1THRBKAT6A
SCHEMBL27913517 0.86 KMT2A (0.78) KMT2ANR1H4SMN1; SMN2MAPTSMPD1
SCHEMBL5250834 0.86 HPGD (0.56) KMT2ANR1H4SMN1; SMN2MAPTNPC1
SCHEMBL1436064 0.85 KMT2A (0.76) KMT2ANR1H4SMN1; SMN2MAPTSMPD1
SCHEMBL609434 0.85 KMT2A (1.00) KMT2ANR1H4SMN1; SMN2SMPD1NPC1
SCHEMBL11052390 0.83 KMT2A (0.73) KMT2ANR1H4SMN1; SMN2MAPTSMPD1
SCHEMBL201524 0.83 KMT2A (0.73) KMT2ANR1H4SMN1; SMN2SMPD1NPC1
SCHEMBL27812355 0.83 KMT2A (0.73) KMT2ANR1H4SMN1; SMN2MAPTSMPD1
SCHEMBL5200730 0.83 KMT2A (0.73) KMT2ANR1H4SMN1; SMN2MAPTSMPD1
SCHEMBL11696519 0.82 KMT2A (0.77) KMT2ANR1H4SMN1; SMN2MAPTSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0765879-B1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO CO (JP) 2001-02-14 EP disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed