SCHEMBL5590874

SCHEMBL5590874

CCOC(=O)C1CCN(c2ncc(C(=O)Nc3nc(-c4cccc(OC)c4)cs3)cc2Cl)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 9/20 0.56
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
P2RY12 Q9H244 1/20 0.49
ALDH1A1 P00352 6/20 0.47
HSD17B10 Q99714 3/20 0.47
HPGD P15428 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
USP2 O75604 2/20 0.46
TSHR P16473 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 4/20 0.46
THRB P10828 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MAPK1 P28482 2/20 0.45
NEK2 P51955 1/20 0.45

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
SCHEMBL5591238 0.92 MPL (0.60) MPLP2RY12ALDH1A1HSD17B10USP2
SCHEMBL5591086 0.92 MPL (0.58) MPLNPC1RAB9AP2RY12ALDH1A1
SCHEMBL5609208 0.91 MPL (0.60) MPLP2RY12
SCHEMBL5591060 0.90 MPL (0.68) MPLNPC1RAB9ANEK2
SCHEMBL5590857 0.88 MPL (0.61) MPL
SCHEMBL5591245 0.87 MPL (0.68) MPLNPC1RAB9AP2RY12MEN1
SCHEMBL5591371 0.87 MPL (0.63) MPL
SCHEMBL5590953 0.86 MPL (0.67) MPL
SCHEMBL5591424 0.84 MPL (0.52) MPLNPC1RAB9AP2RY12MAPT
SCHEMBL5026777 0.84 MPL (0.55) MPLRAB9AP2RY12MAPT

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