SCHEMBL1480205

SCHEMBL1480205

O=S(=O)(O)c1ccc2c(c1)OCCOCCOCCOCCOCCOCCOc1ccccc1O2

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.52
PKLR P30613 3/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
CRHBP P24387 2/20 0.50
CRHR2 Q13324 2/20 0.50
HTT P42858 2/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ATM Q13315 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.47

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
SCHEMBL2986914 0.86 PKM (0.66) PKMPKLRNPC1RAB9AHTT
SCHEMBL30140539 0.86 PKM (0.66) PKMPKLRNPC1RAB9AHTT
Hydrochloric Acid SCHEMBL27738679 0.84 PKM (0.64) PKMPKLRNPC1RAB9AHTT
SCHEMBL14501843 0.82 PKM (0.58) PKMPKLRNPC1RAB9AKDM4E
SCHEMBL30153814 0.82 TSHR (0.46) PKMPKLRNPC1RAB9AKDM4E
SCHEMBL4747547 0.79 PKM (0.57) PKMPKLRNPC1RAB9ALMNA
Fluoride SCHEMBL27399354 0.77 PKM (0.54) PKMPKLRNPC1RAB9AKDM4E
SCHEMBL1262733 0.77 LMNA (0.85) NPC1RAB9AKDM4ELMNASMN1; SMN2
SCHEMBL35680 0.77 LMNA (0.85) NPC1RAB9AKDM4ELMNASMN1; SMN2
SCHEMBL35766 0.77 LMNA (0.85) NPC1RAB9AKDM4ELMNASMN1; 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
US-7913541-B2 Acoustic wave sensing devices; enhanced sensing due to the amino groups reacting with CO2 HONEYWELL INTERNATIONAL INC. (US) 2011-03-29 US disclosed