SCHEMBL7150621

SCHEMBL7150621

COc1ccc([C@@H](O)CN[C@H](C)Cc2ccccc2)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 14/20 0.62
▸ ADRB3 P13945 5/20 0.59
▸ ADRB1 P08588 2/20 0.59
▸ SLC22A3 O75751 1/20 0.53
▸ CASP3 P42574 1/20 0.52
▸ CASP6 P55212 1/20 0.52

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
SCHEMBL7150618 1.00 ADRB2 (0.62) ADRB2ADRB3ADRB1SLC22A3CASP3
SCHEMBL7153505 0.89 ADRB2 (0.58) ADRB2ADRB3ADRB1CASP3CASP6
SCHEMBL7153507 0.89 ADRB2 (0.58) ADRB2ADRB3ADRB1CASP3CASP6
SCHEMBL7150543 0.87 ADRB1 (0.65) ADRB2ADRB3ADRB1
SCHEMBL7150546 0.87 ADRB1 (0.65) ADRB2ADRB3ADRB1
SCHEMBL9117884 0.87 ADRB1 (0.65) ADRB2ADRB3ADRB1
SCHEMBL7042336 0.85 TP53 (0.56) ADRB2ADRB3
SCHEMBL7147229 0.84 ADRB3 (0.57) ADRB2ADRB3ADRB1CASP3CASP6
SCHEMBL7147232 0.84 ADRB3 (0.57) ADRB2ADRB3ADRB1CASP3CASP6
SCHEMBL14137931 0.84 SLC22A3 (0.61) ADRB2ADRB3ADRB1SLC22A3

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-0924193-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 — — 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
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
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