SCHEMBL4154583

SCHEMBL4154583

C=C(CC(=O)OC12CC3CC(CC(C3)C1)C2)C(=O)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.44
EPHX2 P34913 2/20 0.43
CYP17A1 P05093 1/20 0.40
NPSR1 Q6W5P4 2/20 0.38
TSHR P16473 2/20 0.38
NAAA Q02083 1/20 0.36
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
CA2 P00918 1/20 0.33
EPHX1 P07099 1/20 0.33
HSP90AA1 P07900 1/20 0.32
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32
SKP2 Q13309 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL22615613 0.86 CYP19A1 (0.44) CYP19A1EPHX2CYP17A1NPSR1TSHR
SCHEMBL4154588 0.86 CYP19A1 (0.38) CYP19A1EPHX2CYP17A1NPSR1TSHR
SCHEMBL22615808 0.86 LMNA (0.42) CYP19A1EPHX2CYP17A1NPSR1ALDH1A1
SCHEMBL22615855 0.85 CYP19A1 (0.39) CYP19A1EPHX2CYP17A1NPSR1TSHR
SCHEMBL27436848 0.83 CYP19A1 (0.53) CYP19A1EPHX2CYP17A1NPSR1TSHR
SCHEMBL1271393 0.82 CYP19A1 (0.40) CYP19A1EPHX2CYP17A1NPSR1TSHR
SCHEMBL21123182 0.81 CYP19A1 (0.39) CYP19A1EPHX2CYP17A1NPSR1TSHR
SCHEMBL283707 0.81 CYP19A1 (0.39) CYP19A1EPHX2CYP17A1NPSR1NAAA
SCHEMBL31681090 0.81 CYP19A1 (0.39) CYP19A1EPHX2CYP17A1NPSR1TSHR
SCHEMBL22615684 0.78 CYP19A1 (0.34) CYP19A1EPHX2CYP17A1NPSR1TSHR

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
EP-2090933-A1 Lithographic printing plate precursor and printing method FUJIFILM Corporation (JP) 2009-08-19 EP disclosed
US-20090197205-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PRINTING METHOD FUJIFILM CORPORATION (JP) 2009-08-06 US disclosed