SCHEMBL9805030

SCHEMBL9805030

OCC1CN(c2ccccc2)CO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
BPTF Q12830 1/20 0.38
NOTUM Q6P988 1/20 0.38
GRM2 Q14416 4/20 0.37
LMNA P02545 2/20 0.37
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
ADRB1 P08588 1/20 0.37
HTR3A P46098 1/20 0.37
HTR3D Q70Z44 1/20 0.37
HTR3C Q8WXA8 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
PHGDH O43175 1/20 0.35
MGLL Q99685 1/20 0.35

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
SCHEMBL28276522 0.83 ADORA2A (0.54) ADORA2AADORA1BPTFNOTUMLMNA
SCHEMBL10768009 0.76 MTNR1A (0.47) MAOAMAOBLMNAADRB1
SCHEMBL11656879 0.74 DRD4 (0.51) SIGMAR1
SCHEMBL24296225 0.73 MEN1 (0.34) RAB9A
Glycidol SCHEMBL27983974 0.72 L3MBTL1 (0.45) LMNAHTR3EHTR3BADRB1HTR3A
SCHEMBL28101236 0.72 CALML3 (0.39) MAOAMAOB
SCHEMBL4637208 0.71 NOTUM (0.49) BPTFNOTUMLMNASIGMAR1MAPT
SCHEMBL2248619 0.71 NOTUM (0.49) BPTFNOTUMLMNASIGMAR1MAPT
SCHEMBL31411596 0.71 BPTF (0.48) BPTFNOTUMLMNAHTR3EHTR3B
SCHEMBL3751558 0.70 GRM2 (0.46) GRM2

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
JP-3099069-A None JP disclosed
JP-H0399069-A NEW OXAZOLIDINONE AND-THIONE AS PLANT GROWTH REGULATOR CIBA GEIGY AG 1991-04-24 JP disclosed