SCHEMBL7318569

SCHEMBL7318569

COC(=O)C1CCC[C@H]1CO

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM3 P20309 1/20 0.43
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
HDAC8 Q9BY41 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32
HDAC1 Q13547 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 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
SCHEMBL4135157 1.00 CHRM2 (0.43) CHRM2CHRM4CHRM3SLC6A2SLC6A4
SCHEMBL4135155 1.00 CHRM2 (0.43) CHRM2CHRM4CHRM3SLC6A2SLC6A4
SCHEMBL4135152 1.00 CHRM2 (0.43) CHRM2CHRM4CHRM3SLC6A2SLC6A4
SCHEMBL30472636 0.96 SLC6A2 (0.40) CHRM2CHRM4CHRM3SLC6A2SLC6A4
SCHEMBL30472587 0.96 SLC6A2 (0.40) CHRM2CHRM4CHRM3SLC6A2SLC6A4
SCHEMBL1934486 0.96 SLC6A2 (0.40) CHRM2CHRM4CHRM3SLC6A2SLC6A4
SCHEMBL228642 0.88 CHRM2 (0.42) CHRM2CHRM4CHRM3TSHR
SCHEMBL17718015 0.88 CHRM2 (0.42) CHRM2CHRM4CHRM3TSHR
SCHEMBL16699878 0.88 CHRM2 (0.42) CHRM2CHRM4CHRM3TSHR
SCHEMBL228643 0.88 CHRM2 (0.42) CHRM2CHRM4CHRM3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0275482-B1 PROLINE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1993-01-20 EP disclosed
US-5112847-A PROLINAL DERIVATIVES HAVING INHIBITORY ACTIVITY ON PROLYL ENDOPEPTIDASE ONO PHARMACEUTICAL CO., LTD. (JP) 1992-05-12 US disclosed
US-4983624-A Anemia ONO PHARMACEUTICAL CO., LTD (JP) 1991-01-08 US disclosed
EP-0275482-A2 Proline derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-07-27 EP disclosed