SCHEMBL2130516

SCHEMBL2130516

COc1c(CO[Si](C(C)C)(C(C)C)C(C)C)cc(Br)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SIGMAR1 Q99720 12/20 0.35
DRD3 P35462 5/20 0.35
DRD2 P14416 2/20 0.35
DRD4 P21917 1/20 0.35
NQO2 P16083 1/20 0.33

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
SCHEMBL8818405 0.77 KDM4E (0.50) KDM4EALDH1A1MAPK1SMN1; SMN2SIGMAR1
Hydrochloric Acid SCHEMBL5962952 0.74 HTR2A (0.48)
SCHEMBL8202171 0.74 IDO1 (0.50) ALDH1A1SMN1; SMN2
SCHEMBL2130542 0.72 CYP1A2 (0.34) KDM4EALDH1A1
SCHEMBL1620372 0.72 ALOX15 (0.36)
SCHEMBL9749737 0.72 GPR55 (0.47) KDM4EALDH1A1MAPK1SMN1; SMN2SIGMAR1
SCHEMBL2131499 0.71 PLAU (0.35) ALDH1A1
SCHEMBL2280889 0.71 HPGD (0.41)
SCHEMBL2130493 0.70
SCHEMBL152741 0.69 KDM4E (0.58) KDM4EALDH1A1MAPK1SMN1; SMN2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541380-B2 C-aryl glucoside SGLT2 inhibitors and pharmaceutical compositions comprising same GREEN CROSS CORPORATION (KR) 2013-09-24 US disclosed
US-20120101051-A1 NOVEL C-ARYL GLUCOSIDE SGLT2 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME GREEN CROSS CORPORATION (KR) 2012-04-26 US disclosed
WO-2010147430-A2 NOVEL C-ARYL GLUCOSIDE SGLT2 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2010-12-23 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-20120101051-A1 NOVEL C-ARYL GLUCOSIDE SGLT2 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME SLC5A2, SLC5A1, SLC2A2 KDM4E 1273/4885ALDH1A1 1785/4885MAPK1 544/4885

“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.