SCHEMBL4168290

SCHEMBL4168290

COc1ccc(N2C(=O)[C@](C)(O[Si](C)(C)C(C)(C)C)[C@@H]2c2ncccn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.54
KCNH2 Q12809 1/20 0.45
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
POLB P06746 1/20 0.40
SOAT1 P35610 1/20 0.39
TNKS O95271 3/20 0.37

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
SCHEMBL4168294 1.00 HSD11B1 (0.54) HSD11B1KCNH2MEN1MAPTKMT2A
SCHEMBL4168296 1.00 HSD11B1 (0.54) HSD11B1KCNH2MEN1MAPTKMT2A
SCHEMBL4189493 0.79 HSD11B1 (0.46) HSD11B1KCNH2MEN1MAPTKMT2A
SCHEMBL4189630 0.79 HSD11B1 (0.43) HSD11B1KCNH2MEN1MAPTKMT2A
SCHEMBL4183859 0.78 HSD11B1 (0.42) HSD11B1KCNH2MEN1MAPTKMT2A
SCHEMBL4175086 0.66
SCHEMBL8103610 0.65 HSD11B1 (1.00) HSD11B1KCNH2POLBSOAT1
SCHEMBL4177734 0.63 HSD11B1 (0.48) HSD11B1KCNH2MEN1MAPTKMT2A
SCHEMBL4617863 0.63 HSD11B1 (0.48) HSD11B1KCNH2MEN1MAPTKMT2A
SCHEMBL19248171 0.62 HSD11B1 (1.00) HSD11B1KCNH2

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-20090186868-A1 Taxane Compound Having Azetidine Ring Structure DAIICHI SANKYO COMPANY LIMITED (JP) 2009-07-23 US disclosed
US-20090186868-A1 Taxane Compound Having Azetidine Ring Structure DAIICHI SANKYO COMPANY LIMITED (JP) 2009-07-23 US disclosed
EP-1942109-A1 TAXANE COMPOUND WITH AZETIDINE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2008-07-09 EP 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-20090186868-A1 Taxane Compound Having Azetidine Ring Structure ABCC1, AZI2, TPD52L2 HSD11B1 1690/4885KCNH2 1289/4885MEN1 1676/4885

“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.