SCHEMBL17357645

SCHEMBL17357645

COc1ccc(C(OC[C@H](F)[C@H](O)C(O)CO)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 10/20 0.44
AHR P35869 1/20 0.40
SLC6A1 P30531 2/20 0.38
SLC6A11 P48066 1/20 0.38
KCNH2 Q12809 1/20 0.38
TK1 P04183 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL17358593 0.89 KIF11 (0.43) KIF11AHRSLC6A1SLC6A11KCNH2
SCHEMBL9508740 0.85 KIF11 (0.49) KIF11SLC6A1SLC6A11KCNH2TK1
SCHEMBL17357648 0.82 KIF11 (0.42) KIF11AHRSLC6A1SLC6A11KCNH2
SCHEMBL15281845 0.82 KIF11 (0.49) KIF11SLC6A1SLC6A11KCNH2TK1
SCHEMBL3490250 0.82 KIF11 (0.49) KIF11SLC6A1SLC6A11KCNH2TK1
SCHEMBL17359776 0.82 PLA2G2A (0.39) KIF11AHRSLC6A1SLC6A11KCNH2
SCHEMBL16214813 0.81 KIF11 (0.50) KIF11AHRSLC6A1SLC6A11KCNH2
SCHEMBL3487683 0.81 KIF11 (0.50) KIF11AHRSLC6A1SLC6A11KCNH2
SCHEMBL24937040 0.79 LMNA (0.46) KIF11SLC6A1SLC6A11KCNH2MEN1
SCHEMBL10434128 0.79 LMNA (0.46) KIF11SLC6A1SLC6A11KCNH2MEN1

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-20150366888-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-12-24 US disclosed
US-20150366888-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-12-24 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-20150366888-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, TYMP KIF11 4078/4885AHR 3808/4885SLC6A1 3339/4885

“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.