SCHEMBL8868950

SCHEMBL8868950

[O]CCc1ccc(NC(=O)Nc2ccc(F)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.59
KMT2A Q03164 6/20 0.56
MEN1 O00255 4/20 0.56
TAAR1 Q96RJ0 1/20 0.56
GAA P10253 1/20 0.56
FPR2 P25090 1/20 0.55
RAB9A P51151 5/20 0.54
POLB P06746 3/20 0.54
NPC1 O15118 4/20 0.53
HTT P42858 4/20 0.53
MAPT P10636 3/20 0.53
MAPK1 P28482 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
XBP1 P17861 1/20 0.53
HRH3 Q9Y5N1 1/20 0.53
MAOB P27338 1/20 0.53
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA4 P22748 1/20 0.51

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
SCHEMBL8868957 0.86 CNR1 (0.59) CNR1KMT2AMEN1TAAR1GAA
SCHEMBL8867653 0.85 MITF (0.68) KMT2AMEN1GAARAB9APOLB
SCHEMBL4115930 0.84 GAA (0.61) CNR1KMT2AMEN1TAAR1GAA
SCHEMBL8868648 0.84 SMN1; SMN2 (0.63) CNR1KMT2AMEN1TAAR1RAB9A
SCHEMBL3070329 0.82 KMT2A (0.76) KMT2AMEN1TAAR1RAB9APOLB
SCHEMBL8866768 0.82 RAB9A (0.68) CNR1KMT2AMEN1GAARAB9A
SCHEMBL8867408 0.82 KMT2A (0.59) KMT2AMEN1TAAR1RAB9ANPC1
SCHEMBL8867735 0.81 NPC1 (0.68) KMT2AMEN1GAARAB9APOLB
SCHEMBL696776 0.80 TAAR1 (0.56) TAAR1MAOB
SCHEMBL4117952 0.80 RAB9A (0.67) KMT2AMEN1TAAR1GAARAB9A

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