SCHEMBL12410591

SCHEMBL12410591

O=CCNC(=O)c1ccc(OC(=O)N/B=N/P)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
NPC1 O15118 4/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KMT2A Q03164 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 4/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP2 P08253 1/20 0.33
CA9 Q16790 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.32
MGLL Q99685 1/20 0.32
MMP13 P45452 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL12410458 0.84 NPC1 (0.40) PKMNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL14863999 0.78 PKM (0.50) PKMNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL12412446 0.77 PKM (0.49) PKMNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL13049166 0.74 PKM (0.51) PKMNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL12410462 0.71 CYP4F2 (0.41) NPC1RAB9ASMN1; SMN2CA1CA2
SCHEMBL12410588 0.71 GAA (0.42) SMN1; SMN2ALDH1A1
SCHEMBL22811121 0.71 PKM (0.73) PKMNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL17426918 0.69 LMNA (0.45) PKMRAB9ASMN1; SMN2KMT2AHPGD
SCHEMBL13397224 0.67 ALDH1A1 (0.51) PKMNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL12143611 0.66 LMNA (0.45) PKMRAB9ASMN1; SMN2KMT2AHPGD

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-8449872-B2 Polymer conjugates of nesiritide peptides NEKTAR THERAPEUTICS (US) 2013-05-28 US disclosed
US-20110165111-A1 POLYMER CONJUGATES OF NESIRITIDE PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 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-20110165111-A1 POLYMER CONJUGATES OF NESIRITIDE PEPTIDES NGLY1, IAPP, NPSR1 PKM 4156/4885NPC1 759/4885RAB9A 3064/4885

“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.