SCHEMBL1225548

SCHEMBL1225548

O=C(NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.58
RAB9A P51151 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
GAA P10253 2/20 0.52
BACE1 P56817 1/20 0.47
EPHX2 P34913 1/20 0.46
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
PRSS1 P07477 1/20 0.42
CTSG P08311 1/20 0.42
CTRB1 P17538 1/20 0.42
CMA1 P23946 1/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 2/20 0.42
RECQL P46063 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL7689672 1.00 NPC1 (0.58) NPC1RAB9ASMN1; SMN2GAABACE1
SCHEMBL30483952 0.91 NPC1 (0.51) NPC1RAB9ASMN1; SMN2EPHX2LMNA
Mannitol SCHEMBL29038510 0.84 ALDH1A1 (0.47) NPC1RAB9ASMN1; SMN2GAAEPHX2
SCHEMBL7148071 0.83 NPC1 (0.54) NPC1RAB9ASMN1; SMN2GAABACE1
SCHEMBL18992673 0.82 THRB (0.61) NPC1RAB9ASMN1; SMN2EPHX2KMT2A
SCHEMBL30809838 0.82 ATM (0.60) NPC1RAB9ASMN1; SMN2GAAKMT2A
SCHEMBL3465056 0.81 NPC1 (0.64) NPC1RAB9ASMN1; SMN2GAABACE1
SCHEMBL6154030 0.81 NPC1 (0.64) NPC1RAB9ASMN1; SMN2GAABACE1
SCHEMBL20234449 0.80 SMN1; SMN2 (0.48) NPC1RAB9ASMN1; SMN2GAABACE1
SCHEMBL19334001 0.79 SMN1; SMN2 (0.62) NPC1RAB9ASMN1; SMN2GAABACE1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9045523-B2 Compounds PHAROS PHARMACEUTICALS INC. (US) 2015-06-02 US disclosed
EP-2586786-A1 Sulphated amino sugars with anti-inflammatory properties Diosamine Development Corporation (US) 2013-05-01 EP disclosed
US-20110044901-A1 NOVEL COMPOUNDS DIOSAMINE DEVELOPMENT CORPORATION (US) 2011-02-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110044901-A1 NOVEL COMPOUNDS AREG, CCL2, CRH NPC1 4848/4885RAB9A 3073/4885SMN1; SMN2 3745/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.