SCHEMBL2870367

SCHEMBL2870367

CC(C)[Si](C#Cc1ccc(B(O)O)cc1)(C(C)C)C(C)C.CC(C)[Si](C#Cc1ccc(Cc2cc(Br)ccc2Cl)cc1)(C(C)C)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
TSHR P16473 1/20 0.31
DCTPP1 Q9H773 1/20 0.31
SLC5A1 P13866 2/20 0.31
SLC5A2 P31639 2/20 0.31
ACACB O00763 2/20 0.31

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
SCHEMBL1456838 0.91 ACACB (0.33) PTGESSLC5A1SLC5A2ACACB
SCHEMBL2866955 0.88 CA1 (0.32) CA1CA2TSHRACACB
SCHEMBL2874526 0.86 APP (0.30) ACACB
SCHEMBL2866046 0.78 ACACB (0.33) ACACB
SCHEMBL1457124 0.77 ACACB (0.38) ACACB
SCHEMBL4594430 0.76 ENPP2 (0.44) CA1CA2TSHR
SCHEMBL1457449 0.75 LMNA (0.40) ACACB
SCHEMBL1457067 0.70 TAAR1 (0.39) PTGES
SCHEMBL2865494 0.70 ENPP2 (0.38) CA1CA2
SCHEMBL1539252 0.69 SLC5A2 (0.49) SLC5A1SLC5A2

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-7847074-B2 Processes for preparing of glucopyranosyl-substituted (ethynyl-benzyl)-benzene derivatives and intermediates thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-07 US disclosed
US-20070073046-A1 Processes for preparing of glucopyranosyl-substituted (ethynyl-benzyl)-benzene derivatives and intermediates thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-03-29 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-20070073046-A1 Processes for preparing of glucopyranosyl-substituted (ethynyl-benzyl)-benzene derivatives and intermediates thereof UGGT1, B3GAT3, UGCG PTGES 1075/4885CA1 3750/4885CA2 4181/4885

“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.