SCHEMBL30812977

SCHEMBL30812977

CC(=O)OC1CCOc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SSTR4 P31391 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NOTUM Q6P988 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
CHRM4 P08173 2/20 0.37
DRD2 P14416 2/20 0.37
HTR7 P34969 2/20 0.37
MAP3K14 Q99558 1/20 0.37
MAPK1 P28482 1/20 0.37
PKM P14618 1/20 0.36

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
SCHEMBL9785817 1.00 POLB (0.44) POLBGAASMN1; SMN2SSTR4KDM4E
SCHEMBL24262284 0.85 SSTR4 (0.38) POLBGAASMN1; SMN2SSTR4KDM4E
SCHEMBL7300865 0.84 SSTR4 (0.42) GAASMN1; SMN2SSTR4NOTUMTRPV1
SCHEMBL3930074 0.84 POLB (0.46) POLBGAASMN1; SMN2SSTR4
SCHEMBL3923944 0.84 POLB (0.46) POLBGAASMN1; SMN2SSTR4
SCHEMBL21798462 0.84 SSTR4 (0.41) GAASMN1; SMN2SSTR4KDM4ETRPV1
SCHEMBL27720908 0.81 SSTR4 (0.40) GAASMN1; SMN2SSTR4MAPK1
SCHEMBL28001849 0.81 TRPV1 (0.40) GAAKDM4ETRPV1
SCHEMBL29208044 0.80 SSTR4 (0.46) SSTR4KDM4ETRPV1MAPK1PKM
SCHEMBL28788365 0.80 KDM4C (0.43) GAASMN1; SMN2KDM4ETRPV1MAPK1

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-3466934-B1 SULFONAMIDE COMPOUNDS OR SALT THEREOF AS RIBONUCLEOTIDE REDUCTASE INHIBITORS FOR TREATING CANCER TAIHO PHARMACEUTICAL CO LTD (JP) 2024-03-27 EP disclosed