SCHEMBL1978010

SCHEMBL1978010

CC(C)(C)[Si](C)(C)OCCN(CCO[Si](C)(C)C(C)(C)C)S(=O)(=O)c1ccc(CBr)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
LMNA P02545 4/20 0.37
HTT P42858 3/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
BMP1 P13497 6/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
CA12 O43570 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
ABCC2 Q92887 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
UGT1A7 Q9HAW7 1/20 0.34
SLC22A11 Q9NSA0 1/20 0.34

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
SCHEMBL1975415 0.80 TSHR (0.35) SMN1; SMN2LMNAHTTRAB9ANPC1
SCHEMBL7757228 0.80 ALDH1A1 (0.45) SMN1; SMN2TSHRALDH1A1VCAM1NCF1
SCHEMBL8571742 0.77 VCAM1 (0.37) SMN1; SMN2LMNAHTTRAB9ANPC1
SCHEMBL7757769 0.76 VCAM1 (0.36) SMN1; SMN2LMNAHTTRAB9ANPC1
SCHEMBL1975417 0.75 TSHR (0.39) SMN1; SMN2LMNAHTTRAB9ANPC1
SCHEMBL2415090 0.75 SIGMAR1 (0.47) SMN1; SMN2LMNAHTTRAB9ATSHR
SCHEMBL9701756 0.74 DUT (0.36) TSHRALDH1A1
SCHEMBL1975782 0.71 SMN1; SMN2 (0.44) SMN1; SMN2LMNAHTTRAB9ATSHR
SCHEMBL2468075 0.70 LMNA (0.66) SMN1; SMN2LMNAHTTRAB9ANPC1
SCHEMBL2981195 0.70 TRPA1 (0.33) TSHRALDH1A1

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 SMN1; SMN2 278/4885LMNA 472/4885HTT 2051/4885

“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.