SCHEMBL9820710

SCHEMBL9820710

CCCCCCCCOC1CCC(=O)N1Cc1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 5/20 0.49
HCRTR1 O43613 3/20 0.45
GAA P10253 1/20 0.43
TSHR P16473 2/20 0.42
ALOX15 P16050 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 2/20 0.41
HTT P42858 1/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 1/20 0.39
CYP2C9 P11712 1/20 0.39
S1PR5 Q9H228 1/20 0.38

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
SCHEMBL9820618 0.88 MEN1 (0.44) HCRTR2HCRTR1KMT2AMEN1HTT
SCHEMBL9820751 0.88 MEN1 (0.44) HCRTR2HCRTR1KMT2AMEN1HTT
SCHEMBL9820661 0.88 MEN1 (0.44) HCRTR2HCRTR1KMT2AMEN1HTT
SCHEMBL9820709 0.88 MEN1 (0.44) HCRTR2HCRTR1KMT2AMEN1HTT
SCHEMBL9820785 0.88 MEN1 (0.44) HCRTR2HCRTR1KMT2AMEN1HTT
SCHEMBL10554923 0.87 HCRTR2 (0.47) HCRTR2HCRTR1KMT2AALDH1A1S1PR5
SCHEMBL9820831 0.87 HCRTR1 (0.47) HCRTR2HCRTR1KMT2AMEN1HTT
SCHEMBL9820847 0.86 MEN1 (0.45) HCRTR2HCRTR1KMT2AMEN1POLB
SCHEMBL10649332 0.86 KMT2A (0.42) HCRTR2HCRTR1KMT2AMEN1ALDH1A1
SCHEMBL10553316 0.86 HCRTR2 (0.51) HCRTR2HCRTR1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0296978-B1 1-BENZYL 2-OXO 5-ALKOXY PYRROLIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THEIR USE IN MEDICINES ROUSSEL-UCLAF (FR) 1991-09-11 EP disclosed