SCHEMBL1974456

SCHEMBL1974456

CCC(CC)(c1ccc(S(=O)(=O)N2CCN(CCO[Si](C)(C)C(C)(C)C)CC2)cc1)P(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
HTT P42858 2/20 0.39
GAA P10253 2/20 0.38
NPC1 O15118 1/20 0.38
NAMPT P43490 3/20 0.38
HSD11B1 P28845 2/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL1974453 0.78 POLB (0.41) POLBKMT2AALDH1A1LMNATSHR
SCHEMBL1975782 0.78 SMN1; SMN2 (0.44) POLBKMT2AALDH1A1LMNATSHR
SCHEMBL1975417 0.75 TSHR (0.39) KMT2AALDH1A1LMNATSHRL3MBTL1
SCHEMBL12422709 0.71 POLB (0.68) POLBKMT2AALDH1A1LMNATSHR
SCHEMBL15249012 0.67 POLB (0.78) POLBKMT2AALDH1A1LMNATSHR
SCHEMBL12169386 0.66 POLB (0.72) POLBKMT2AALDH1A1LMNATSHR
SCHEMBL27741307 0.65 HSD11B1 (0.34) POLBKMT2AALDH1A1MEN1HSD11B1
SCHEMBL12509539 0.65 NAMPT (0.53) POLBALDH1A1LMNAL3MBTL1RAB9A
SCHEMBL9720805 0.65 ENPP2 (0.42) KMT2ANPC1
SCHEMBL12169346 0.65 L3MBTL1 (0.64) POLBKMT2AALDH1A1LMNAL3MBTL1

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-8658129-B2 Agents and methods for the imaging of myelin basic protein GENERAL ELECTRIC COMPANY (US) 2014-02-25 US disclosed
US-20110142759-A1 AGENTS AND METHODS FOR THE IMAGING OF MYELIN BASIC PROTEIN GENERAL ELECTRIC COMPANY (US) 2011-06-16 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-20110142759-A1 AGENTS AND METHODS FOR THE IMAGING OF MYELIN BASIC PROTEIN MAG, PMP22, MYT1 POLB 2829/4885KMT2A 2659/4885ALDH1A1 4733/4885

“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.