SCHEMBL11568280

SCHEMBL11568280

CCCOC(=O)c1c(C)noc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
GRM6 O15303 1/20 0.44
ALDH1A1 P00352 5/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 3/20 0.42
TSHR P16473 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
PKM P14618 2/20 0.42
RXFP1 Q9HBX9 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 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
SCHEMBL11568715 0.91 TSHR (0.45) MAPTALDH1A1HPGDTSHRNPSR1
SCHEMBL15525136 0.88 ALDH1A1 (0.55) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL11568711 0.83 MAPT (0.41) MAPTGRM6ALDH1A1MEN1KMT2A
SCHEMBL11567522 0.75 CNR2 (0.40) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL5150367 0.74 CYP1A2 (0.45) ALDH1A1MEN1KMT2AHPGDTSHR
SCHEMBL11572113 0.73 ALDH1A1 (0.49) MAPTALDH1A1KMT2AHPGDNPSR1
SCHEMBL11570115 0.73 HSP90AA1 (0.47) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL12323480 0.73 TSHR (0.40) MAPTALDH1A1HPGDTSHRGAA
SCHEMBL11568036 0.72 MAPT (0.47) MAPTALDH1A1KMT2AHPGDNPSR1
SCHEMBL11004733 0.72 ALDH1A1 (0.58) MAPTGRM6ALDH1A1MEN1KMT2A

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
EP-0002881-A1 5-Isoxazolylurea derivatives, their preparation, their use and compositions containing them FISONS plc (GB) 1979-07-11 EP claimed
EP-0002881-A1 5-Isoxazolylurea derivatives, their preparation, their use and compositions containing them FISONS plc (GB) 1979-07-11 EP disclosed