SCHEMBL2734962

SCHEMBL2734962

CCC(C)(C)C(=O)OC12CC3CC(C1)CC(C(=O)OCOC1CCCCC1)(C3)C2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.34
ALDH1A1 P00352 1/20 0.31
DPP4 P27487 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 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
SCHEMBL2734963 0.91 NPSR1 (0.30) NPSR1
SCHEMBL10259462 0.87 DPP4 (0.32) DPP4CYP17A1CYP19A1
SCHEMBL14883982 0.82 NPSR1 (0.32) NPSR1L3MBTL1DPP4CYP17A1CYP19A1
SCHEMBL16706513 0.82
SCHEMBL18802858 0.81 CYP17A1 (0.32) NPSR1L3MBTL1DPP4CYP17A1CYP19A1
SCHEMBL2734971 0.81 NPSR1 (0.39) NPSR1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL14883984 0.81 NPSR1 (0.32) NPSR1L3MBTL1DPP4CYP17A1CYP19A1
SCHEMBL14883979 0.81 NPSR1 (0.36) NPSR1ALDH1A1DPP4CYP17A1CYP19A1
SCHEMBL2735085 0.81 NPSR1 (0.38) NPSR1L3MBTL1ALDH1A1DPP4MEN1
SCHEMBL14883985 0.81 NPSR1 (0.33) NPSR1DPP4CYP17A1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088550-B2 Positive resist composition and pattern forming method FUJIFILM CORPORATION (JP) 2012-01-03 US disclosed
US-20090035692-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING MEHTOD FUJIFILM CORPORATION (JP) 2009-02-05 US disclosed
US-20090023096-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING METHOD FUJIFILM CORPORATION (JP) 2009-01-22 US disclosed