SCHEMBL3304758

SCHEMBL3304758

CC(C)(C)OC(=O)N[C@@H]1CN(NC(=O)OCC[Si](C)(C)C)CC[C@@H]1NC(=O)C(=O)Nc1ccc(Cl)cn1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.35
F10 P00742 2/20 0.35
F2 P00734 1/20 0.35
F5 P12259 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CCR1 P32246 1/20 0.34
EIF2AK4 Q9P2K8 1/20 0.34
TSHR P16473 1/20 0.34
IDO1 P14902 3/20 0.33
USP30 Q70CQ3 1/20 0.33
NAMPT P43490 1/20 0.33
TDO2 P48775 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
SCHEMBL209026 0.88 IDO1 (0.37) F10F2F5L3MBTL1SMN1; SMN2
SCHEMBL208895 0.82 F10 (0.43) F10F2F5L3MBTL1SMN1; SMN2
SCHEMBL207922 0.81 ALDH1A1 (0.44) F10L3MBTL1SMN1; SMN2CCR1TSHR
SCHEMBL209285 0.80 F10 (0.39) F10F2F5L3MBTL1SMN1; SMN2
SCHEMBL210778 0.80 IDO1 (0.42) F10F2F5L3MBTL1CCR1
SCHEMBL209410 0.80 IDO1 (0.39) F10F2F5L3MBTL1SMN1; SMN2
SCHEMBL208900 0.80 DRD2 (0.44) DRD2F10F2F5SMN1; SMN2
SCHEMBL206636 0.80 IDO1 (0.41) F10F2F5L3MBTL1SMN1; SMN2
SCHEMBL207795 0.80 NPC1 (0.39) F10F2F5L3MBTL1CCR1
SCHEMBL209841 0.79 MAPK1 (0.40) F10F2F5L3MBTL1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100099660-A1 METHOD FOR TREATING THROMBOSIS OR EMBOLISM AND RELATED DISEASES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-04-22 US disclosed
US-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM DAIICHI PHARMACEUTICAL CO., LTD (JP) 2009-11-12 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 (2 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-20100099660-A1 METHOD FOR TREATING THROMBOSIS OR EMBOLISM AND RELATED DISEASES F2, PLAT, MPL DRD2 1524/4885F10 152/4885F2 1/4885
US-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM C1R, C9, F2 DRD2 352/4885F10 127/4885F2 3/4885

“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.