SCHEMBL3905396

SCHEMBL3905396

COc1ccc(C(CC(O)C(O)C(S)C(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 11/20 0.50
KCNH2 Q12809 1/20 0.45
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
CASR P41180 1/20 0.34
LTA4H P09960 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
SCHEMBL3902937 0.90 KIF11 (0.50) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL7147740 0.78 KIF11 (0.61) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL19652449 0.74 KIF11 (0.58) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL6039133 0.74 KIF11 (0.46) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL2898260 0.73 KIF11 (0.60) KIF11KCNH2KMT2AMEN1
SCHEMBL14937220 0.73 KIF11 (0.46) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL8399786 0.72 KIF11 (0.43) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL3496480 0.71 KIF11 (0.54) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL27757625 0.71 KIF11 (0.52) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL2686112 0.71 KIF11 (0.64) KIF11KCNH2LMNAHTTSMN1; SMN2

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
EP-1626952-B1 MULTIFUNCTIONAL REAGENT FOR THE SYNTHESIS OF THIOL MODIFIED OLIGOMERS FRIZ BIOCHEM GES FÜR BIOANALYTIK MBH (DE) 2014-06-04 EP disclosed
US-7601848-B2 Multifunctional reagent for the synthesis of thiol modified oligomers FIDICULA GMBH (DE) 2009-10-13 US disclosed
US-20050153291-A1 Multifunctional reagent for the synthesis of thiol modified oligomers FRIZ BIOCHEM GESELLSCHAFT FUR BIOANALYTIK MBH (DE) 2005-07-14 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-20050153291-A1 Multifunctional reagent for the synthesis of thiol modified oligomers CBR3, NOX3, CBR1 KIF11 3893/4885KCNH2 623/4885LMNA 3237/4885

“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.