SCHEMBL17055725

SCHEMBL17055725

OCc1nnc(-c2ccc3c(c2)OCO3)o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.60
▸ NPC1 O15118 7/20 0.60
▸ RAB9A P51151 7/20 0.60
▸ MAPT P10636 7/20 0.60
▸ SMN1; SMN2 Q16637 6/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ TSHR P16473 3/20 0.57
▸ USP2 O75604 2/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ POLB P06746 3/20 0.55
▸ TP53 P04637 4/20 0.55
▸ HSD17B10 Q99714 3/20 0.55
▸ GAA P10253 1/20 0.55
▸ PKM P14618 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ HSP90AA1 P07900 1/20 0.54

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
SCHEMBL3492339 0.84 NPC1 (0.81) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL28987831 0.77 SMN1; SMN2 (0.62) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL24653524 0.76 NPC1 (0.65) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL31040512 0.76 NPC1 (0.65) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL30622710 0.76 NPC1 (0.65) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL391671 0.76 NPC1 (0.65) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL12419565 0.75 NPC1 (0.67) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL12797796 0.74 NPC1 (0.65) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL21792052 0.73 NOTUM (0.73) KDM4ENPC1RAB9AALDH1A1TSHR
SCHEMBL10225785 0.73 NPC1 (0.60) KDM4ENPC1RAB9AMAPTSMN1; SMN2

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
WO-2015129755-A1 NOVEL COMPOUND AND TEXTURE IMPROVER CONTAINING SAID COMPOUND 味の素株式会社 2015-09-03 — — WO disclosed
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