SCHEMBL7653951

SCHEMBL7653951

CCOC1CC(=O)N1Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.44
HCRTR2 O43614 1/20 0.44
EHMT2 Q96KQ7 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL21538635 0.77 ALDH1A1 (0.50) EHMT2KMT2AMEN1ALDH1A1TSHR
SCHEMBL2535132 0.76 EHMT2 (0.47) HCRTR1HCRTR2EHMT2KMT2AMEN1
SCHEMBL2535135 0.76 EHMT2 (0.47) HCRTR1HCRTR2EHMT2KMT2AMEN1
SCHEMBL21538655 0.75 LMNA (0.50) HCRTR1HCRTR2EHMT2KMT2AMEN1
SCHEMBL11069497 0.75 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1
SCHEMBL9820787 0.74 HCRTR2 (0.46) HCRTR1HCRTR2EHMT2KMT2AMEN1
SCHEMBL8094843 0.73 EHMT2 (0.45) HCRTR1HCRTR2EHMT2KMT2AMEN1
SCHEMBL7498416 0.73 EHMT2 (0.45) EHMT2KMT2AMEN1ALDH1A1HPGD
SCHEMBL9631715 0.73 EHMT2 (0.45) EHMT2KMT2AMEN1ALDH1A1HPGD
SCHEMBL3627524 0.73 EHMT2 (0.45) EHMT2KMT2AMEN1ALDH1A1HPGD

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
US-6407228-B1 MIXING ISOCYANATE WITH VINYL ETHER; CYCLIZATION JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2002-06-18 US disclosed