SCHEMBL27487547

SCHEMBL27487547

CCC(=O)OC1=CC(C)(C)CCC1C=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.35
HIF1A Q16665 2/20 0.35
PTPN1 P18031 2/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FGFR1 P11362 1/20 0.32
ELANE P08246 1/20 0.31
CYP19A1 P11511 2/20 0.30
ALOX15 P16050 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
SCHEMBL27555475 0.79 CYP19A1 (0.30) CYP19A1
SCHEMBL27489293 0.72 ESR1 (0.33) ESR1HIF1APTPN1RECQLKMT2A
SCHEMBL27487187 0.70
SCHEMBL27720625 0.69
SCHEMBL17922942 0.68
SCHEMBL27472021 0.67
SCHEMBL27549972 0.67
SCHEMBL27471560 0.66
SCHEMBL27487544 0.66
SCHEMBL27488965 0.65

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
CN-100430049-C Depressant of functions developed by molecule SHOZO KOYAMA (JP) 2008-11-05 CN disclosed
CN-1162918-A Depressant of functions developed by molecule KOYAMA SHOZO (JP) 1997-10-22 CN disclosed