SCHEMBL9309022

SCHEMBL9309022

COC(=O)c1cc(Cl)cc2c1O[C@H]1C=CCC[C@@H]21

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.34
SERPINH1 P50454 1/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ABL1 P00519 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.32
NR4A2 P43354 1/20 0.32
SLC6A3 Q01959 5/20 0.32
SLC6A4 P31645 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31

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
SCHEMBL9151441 0.85 AKR1C4 (0.33) MEN1KMT2APOLBSMN1; SMN2
SCHEMBL9151445 0.85 AKR1C4 (0.33) MEN1KMT2APOLBSMN1; SMN2
SCHEMBL7318335 0.77 KDM4E (0.39) OPRK1SERPINH1MEN1KMT2AABL1
SCHEMBL7317477 0.77 KDM4E (0.39) OPRK1SERPINH1MEN1KMT2AABL1
SCHEMBL7311217 0.77 KDM4E (0.39) OPRK1SERPINH1MEN1KMT2AABL1
SCHEMBL7414700 0.71 SLC6A3 (0.38) OPRK1SERPINH1MEN1KMT2AABL1
SCHEMBL7414698 0.71 SLC6A3 (0.38) OPRK1SERPINH1MEN1KMT2AABL1
SCHEMBL12036045 0.68 PARP1 (0.48) SERPINH1MEN1KMT2AABL1SIRT2
SCHEMBL7399556 0.67 LMNA (0.38) OPRK1SERPINH1MEN1KMT2AABL1
SCHEMBL8364696 0.65 HTR3A (0.50) SERPINH1ABL1SLC6A3SLC6A4HCRTR1

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
US-5278323-A Process for preparing chiral dibenzofurans via intramolecular heck reaction RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-01-11 US claimed
US-5278323-A Process for preparing chiral dibenzofurans via intramolecular heck reaction RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-01-11 US disclosed