SCHEMBL15318100

SCHEMBL15318100

CCN(CC)c1ccc2c(c1)CC1=CC(=[N+](CC)CC)C=CC1=C2c1ccc(N=C=S)cc1C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ HSP90AA1 P07900 2/20 0.31
▸ NSD2 O96028 1/20 0.31
▸ G6PD P11413 1/20 0.31
▸ CDK5 Q00535 1/20 0.31
▸ CDK5R1 Q15078 1/20 0.31
▸ TLR9 Q9NR96 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
SCHEMBL15672423 0.75 TDP1 (0.36) MEN1KMT2ASMN1; SMN2L3MBTL1TDP1
SCHEMBL15318098 0.75 TLR7 (0.34) —
SCHEMBL12606025 0.74 ESR2 (0.35) MEN1KMT2A
SCHEMBL16674126 0.73 HSP90AA1 (0.38) MEN1KMT2ATDP1HDAC6HSP90AA1
SCHEMBL20647844 0.71 — —
SCHEMBL14268588 0.70 TDP1 (0.38) MEN1KMT2ASMN1; SMN2L3MBTL1TDP1
SCHEMBL12216725 0.67 MEN1 (0.55) MEN1KMT2ASMN1; SMN2L3MBTL1TDP1
Hydrochloric Acid SCHEMBL29349953 0.66 MEN1 (0.54) MEN1KMT2ASMN1; SMN2TDP1
Hydrochloric Acid SCHEMBL16593584 0.66 MEN1 (0.54) MEN1KMT2ASMN1; SMN2TDP1
SCHEMBL15177503 0.66 SMN1; SMN2 (0.39) MEN1KMT2ASMN1; SMN2L3MBTL1TDP1

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-9028880-B2 Silica nanoparticle agent conjugates THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2015-05-12 — — US disclosed
US-20130274226-A1 SILICA NANOPARTICLE AGENT CONJUGATES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2013-10-17 — — 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-20130274226-A1 SILICA NANOPARTICLE AGENT CONJUGATES TST, NCL, MSN MEN1 3680/4885KMT2A 1071/4885SMN1; SMN2 3254/4885

“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.

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