SCHEMBL882947

SCHEMBL882947

COC(=O)C1=NC[C@H](O)[C@H]1C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.35
TLR4 O00206 1/20 0.33
GLA P06280 1/20 0.32
FUCA1 P04066 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL3430646 0.71
SCHEMBL11368420 0.69 NPSR1 (0.35) NPSR1ALDH1A1
SCHEMBL883032 0.67 NOS3 (0.39) NPSR1ALDH1A1
SCHEMBL3430483 0.63
SCHEMBL10609389 0.63 NPSR1 (0.37) NPSR1
SCHEMBL10609396 0.63 NPSR1 (0.37) NPSR1
SCHEMBL6382886 0.61 NPSR1 (0.35) NPSR1ALDH1A1
SCHEMBL14007321 0.61 SMN1; SMN2 (0.36) NPSR1GLAALDH1A1
SCHEMBL3478899 0.61
SCHEMBL17616387 0.58 NPSR1 (0.40) NPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-04-19 US disclosed
WO-2012040242-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-03-29 WO 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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION VIP, EIF2AK2, PREP NPSR1 4141/4885TLR4 1085/4885GLA 1649/4885

“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.