SCHEMBL8318801

SCHEMBL8318801

O=C(COc1ccc(C(=O)CNC(=O)c2cc3c(s2)CCNC3)cc1COc1cccnc1)OC(=O)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 10/20 0.55
ITGA2B P08514 10/20 0.55
TPSAB1 Q15661 1/20 0.34
TPSD1 Q9BZJ3 1/20 0.34
TPSG1 Q9NRR2 1/20 0.34
PNMT P11086 2/20 0.32
SLC8A1 P32418 1/20 0.30
MAPK14 Q16539 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL8318794 0.91 ITGB3 (0.64) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8318299 0.90 ITGB3 (0.69) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8318813 0.84 ITGB3 (0.56) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8558568 0.83 ITGB3 (0.67) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8553813 0.82 ITGB3 (0.69) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8557633 0.82 ITGB3 (0.76) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8558875 0.80 ITGB3 (0.69) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8557196 0.80 ITGB3 (0.69) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8555288 0.79 ITGB3 (0.65) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8318658 0.77 ITGB3 (0.48) ITGB3ITGA2BTPSAB1TPSD1TPSG1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0897920-A1 NOVEL HETEROCYCLIC COMPOUNDS HAVING PLATELET AGGREGATION INHIBITORY EFFECTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-02-24 EP disclosed