SCHEMBL11368798

SCHEMBL11368798

O=C(O)C1CCC(c2ccccc2O)=N1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.42
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
ATM Q13315 2/20 0.39
HSP90AA1 P07900 1/20 0.39
MAOA P21397 2/20 0.39
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
MAOB P27338 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
BCL2L1 Q07817 1/20 0.37
BCHE P06276 1/20 0.37
AOC1 P19801 1/20 0.36

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
SCHEMBL28788872 0.83 KIF11 (0.43) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL28788871 0.83 KIF11 (0.43) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL9542642 0.80 RAB9A (0.39) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL14328250 0.80 RAB9A (0.39) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL29442058 0.74 KDM4E (0.41) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL9218476 0.74 KDM4E (0.41) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL18114343 0.73 MIF (0.41) MEN1KMT2AMAOAMAOBRAB9A
SCHEMBL22534057 0.73 MIF (0.41) MEN1KMT2AMAOAMAOBRAB9A
Hydrochloric Acid SCHEMBL22534094 0.72 MIF (0.40) MEN1KMT2AMAOAMAOBRAB9A
Hydrochloric Acid SCHEMBL22534093 0.72 MIF (0.40) MEN1KMT2AMAOAMAOBRAB9A

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-4264620-A HYPOTENSIVE AGENTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1981-04-28 US disclosed