SCHEMBL5591027

SCHEMBL5591027

NC(=O)c1nc(-c2cccc(C(F)(F)F)c2F)cs1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MPL P40238 18/20 0.67
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
SCN9A Q15858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL474161 0.80 MPL (1.00) MPL
SCHEMBL5999201 0.77 MPL (0.61) MPLCYP3A4CYP2D6CYP2C9SCN9A
SCHEMBL8117023 0.74 MPL (0.67) MPLCYP3A4CYP2D6CYP2C9SCN9A
SCHEMBL6686667 0.73 HTR2B (0.56) CYP3A4CYP2D6CYP2C9SCN9A
SCHEMBL4367503 0.73 SMN1; SMN2 (0.55) MPLCYP3A4CYP2D6CYP2C9SCN9A
SCHEMBL7432599 0.72 HTR2C (0.60) MPLCYP3A4CYP2D6CYP2C9SCN9A
SCHEMBL7440522 0.72 CYP3A4 (0.61) CYP3A4CYP2D6CYP2C9SCN9A
SCHEMBL1198042 0.72 MPL (0.53) MPL
SCHEMBL5446093 0.72 SCN9A (0.66) MPLCYP3A4CYP2D6CYP2C9SCN9A
SCHEMBL6660568 0.72 ATP4A (0.58) CYP3A4CYP2D6CYP2C9SCN9AL3MBTL1

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
WO-2007004038-A1 AMINOTHIAZOLE DERIVATIVES AS AGONISTS OF THE THROMBOPOIETIN RECEPTOR PFIZER PRODUCTS INC. (US) 2007-01-11 WO claimed
WO-2007004038-A1 AMINOTHIAZOLE DERIVATIVES AS AGONISTS OF THE THROMBOPOIETIN RECEPTOR PFIZER PRODUCTS INC. (US) 2007-01-11 WO disclosed