SCHEMBL8867294

SCHEMBL8867294

O=C(Nc1ccccc1)Nc1cccc(/C=C/CO)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.53
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
TP53 P04637 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
EPHX1 P07099 1/20 0.52
TSHR P16473 1/20 0.52
EPHX2 P34913 1/20 0.52
CDK9 P50750 1/20 0.52
CLK4 Q9HAZ1 1/20 0.52
MAPT P10636 5/20 0.51
RAB9A P51151 3/20 0.51
HTT P42858 2/20 0.51
NPC1 O15118 2/20 0.51
LMNA P02545 1/20 0.51
MAOA P21397 3/20 0.50
PKM P14618 1/20 0.50
MGLL Q99685 1/20 0.50
SIRT1 Q96EB6 1/20 0.50
RHOA P61586 1/20 0.49

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
SCHEMBL8867288 0.88 MAOB (0.53) MAOBMEN1KMT2ATP53SMN1; SMN2
SCHEMBL8867284 0.88 MAOB (0.53) MAOBMEN1KMT2ATP53SMN1; SMN2
SCHEMBL8867685 0.87 MAOB (0.46) MAOBMEN1KMT2AMAPTMAOA
SCHEMBL8867766 0.86 NPC1 (0.57) MAOBMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL8867071 0.85 KMT2A (0.53) MAOBMEN1KMT2AMAPTRAB9A
SCHEMBL8867060 0.85 FGFR3 (0.44) MAOBMEN1KMT2AMAPTHTT
SCHEMBL8867748 0.84 FGFR3 (0.45) MAOBMEN1KMT2AMAPTHTT
SCHEMBL8866966 0.84 MAPT (0.46) MAOBSMN1; SMN2EPHX1MAPTRAB9A
SCHEMBL8868719 0.84 NPC1 (0.50) MAOBMEN1KMT2ATP53SMN1; SMN2
SCHEMBL8868715 0.83 CA12 (0.51) MAOBMEN1KMT2AMAPTMAOA

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-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 US disclosed