SCHEMBL7146276

SCHEMBL7146276

CCOc1cc(O)cc([C@@H](O)CN)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.43
TSHR P16473 3/20 0.43
HIF1A Q16665 3/20 0.43
NFKB1 P19838 2/20 0.43
HTR3A P46098 1/20 0.43
APEX1 P27695 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ALOX15 P16050 1/20 0.42
ADRB2 P07550 3/20 0.40
LMNA P02545 2/20 0.40
CYP3A4 P08684 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP2C9 P11712 1/20 0.40
CASP7 P55210 1/20 0.40
BLM P54132 3/20 0.40
ADRA1A P35348 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
RECQL P46063 2/20 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
SCHEMBL7150347 0.90 ADRA2A (0.42) TAAR1TSHRHIF1ANFKB1HTR3A
SCHEMBL14217556 0.84 TAAR1 (0.41) TAAR1TSHRHIF1ANFKB1HTR3A
SCHEMBL7151251 0.83 NFKB1 (0.50) TAAR1TSHRHIF1ANFKB1HTR3A
SCHEMBL13085659 0.79 MAPT (0.43) TSHRTDP1KDM4EKMT2AMAPT
SCHEMBL9319979 0.78 TSHR (0.60) TAAR1TSHRHIF1ANFKB1HTR3A
SCHEMBL7151403 0.78 TSHR (0.60) TAAR1TSHRHIF1ANFKB1HTR3A
SCHEMBL7151271 0.77 TP53 (0.51) TSHRHIF1ANFKB1APEX1TDP1
SCHEMBL2493501 0.75 LTA4H (0.52) TSHRTDP1CYP3A4MAPTADRA2A
SCHEMBL70827 0.75 LTA4H (0.52) TSHRTDP1CYP3A4MAPTADRA2A
SCHEMBL7148796 0.75 NQO1 (0.54) TAAR1TSHRHIF1ANFKB1HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030143701-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. 2003-07-31 US disclosed
EP-0924194-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2003-05-14 EP disclosed
US-6528686-B1 Reacting primary amine and ketone functionalized derivatives; catalytically reducing DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-03-04 US disclosed
EP-0924193-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2003-02-19 EP disclosed
EP-0939134-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2002-09-11 EP disclosed
US-6114582-A DECYCLIZATION TO FORM A CHEMICAL INTERMEDIATE FOR PRODUCING AN ANTI-OBESITY AGENT AND ANTIDIABETIC AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-05 US disclosed
EP-0654534-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2000-03-01 EP disclosed
EP-0939134-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-01 EP disclosed
EP-0924194-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 EP disclosed
EP-0924193-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 EP disclosed
US-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US disclosed
US-5629200-A MICROORGANISM DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1997-05-13 US disclosed
EP-0654534-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1995-05-24 EP disclosed