SCHEMBL2852257

SCHEMBL2852257

NCC(O)c1ccc(O)c(CO)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 10/20 0.67
BLM P54132 5/20 0.67
TDP1 Q9NUW8 4/20 0.67
MAPT P10636 3/20 0.67
RECQL P46063 3/20 0.67
ADRB1 P08588 3/20 0.67
KDM4E B2RXH2 3/20 0.67
HPGD P15428 2/20 0.67
APEX1 P27695 2/20 0.67
LMNA P02545 2/20 0.67
MAPK1 P28482 2/20 0.67
ADRA2A P08913 2/20 0.67
ADRA2B P18089 2/20 0.67
ADRA2C P18825 2/20 0.67
ADRA1D P25100 2/20 0.67
MEN1 O00255 1/20 0.67
ADORA3 P0DMS8 1/20 0.67
ADRB3 P13945 1/20 0.67
DRD2 P14416 1/20 0.67
DRD1 P21728 1/20 0.67

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
SCHEMBL7152531 1.00 ADRB2 (0.67) ADRB2BLMTDP1MAPTRECQL
SCHEMBL28290091 0.85 BLM (0.67) ADRB2BLMTDP1MAPTRECQL
SCHEMBL15061878 0.84 BLM (0.65) ADRB2BLMTDP1MAPTRECQL
SCHEMBL1311066 0.81 ADRB2 (0.59) ADRB2TDP1ADRB1NFKB1TSHR
SCHEMBL6462710 0.81 ADRB2 (0.59) ADRB2TDP1ADRB1NFKB1TSHR
SCHEMBL1311067 0.81 ADRB2 (0.59) ADRB2TDP1ADRB1NFKB1TSHR
SCHEMBL14291852 0.81 ADRB2 (0.62) ADRB2TDP1ADRB1CYP3A4NFKB1
SCHEMBL19236388 0.81 ADRB2 (0.62) ADRB2TDP1ADRB1CYP3A4NFKB1
SCHEMBL14622394 0.81 ADRB2 (0.54) ADRB2TDP1ADRB1NFKB1TSHR
L-Norepinephrine SCHEMBL3489077 0.80 TDP1 (1.00) ADRB2BLMTDP1MAPTRECQL

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107271665-B Test strip for detecting salbutamol and application thereof 北京望尔生物技术有限公司 2020-06-23 CN claimed
CN-107271665-B Test strip for detecting salbutamol and application thereof 北京望尔生物技术有限公司 2020-06-23 CN disclosed
EP-3201171-B1 METHOD OF PREPARING INTERMEDIATE OF SALMETEROL AMPHASTAR NANJING PHARMACEUTICALS INC (CN) 2020-04-15 EP disclosed
CN-109694376-B Beta-beta2Receptor agonist compounds and their use in the treatment of asthma 黑龙江中医药大学 2019-12-27 CN disclosed
CN-109694376-A Novel β2Receptor agonist compounds and its treatment asthma class disease purposes 黑龙江中医药大学 2019-04-30 CN disclosed
WO-2017168431-A1 PROCESS FOR THE PREPARATION OF SALMETEROL XINAFOATE DAVULURI RAMAMOHAN RAO (IN) 2017-10-05 WO disclosed
WO-2017168431-A1 PROCESS FOR THE PREPARATION OF SALMETEROL XINAFOATE DAVULURI RAMAMOHAN RAO (IN) 2017-10-05 WO disclosed
US-9447067-B2 Method of preparing intermediate of salmeterol Amphastar Pahmaceuticals, Inc. (US) 2016-09-20 US disclosed
US-9447067-B2 Method of preparing intermediate of salmeterol Amphastar Pahmaceuticals, Inc. (US) 2016-09-20 US disclosed
US-20160096816-A1 METHOD OF PREPARING INTERMEDIATE OF SALMETEROL AMPHASTAR NANJING PHARMACEUTICALS INC. (CN) 2016-04-07 US disclosed
US-4654371-A ANTI-OBESITY, HYPOGLYCEMIA AGENTS BEECHAM GROUP P.L.C. (GB) 1987-03-31 US disclosed
US-4478849-A HYPERGLYCEMIC AGENTS BEECHAM GROUP LIMITED (GB) 1984-10-23 US disclosed
US-4396627-A HYPOGLYCEMIC AGENTS, TREATMENT OF OBECITY BEECHAM GROUP LIMITED (GB) 1983-08-02 US disclosed
EP-0006735-B1 SECONDARY AMINES, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE BEECHAM GROUP PLC (GB) 1983-06-15 EP disclosed
EP-0023385-B1 ETHANAMINE DERIVATIVES, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1982-12-15 EP disclosed
EP-0021636-B1 SECONDARY AMINES, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1982-12-01 EP disclosed
US-4338333-A ANTIOBESITY, HYPOGLYCEMIC BEECHAM GROUP LIMITED (GB) 1982-07-06 US disclosed
EP-0023385-A1 Ethanamine derivatives, their preparation and use in pharmaceutical compositions BEECHAM GROUP PLC (GB) 1981-02-04 EP disclosed
EP-0021636-A1 Secondary amines, their preparation and use in pharmaceutical compositions BEECHAM GROUP PLC (GB) 1981-01-07 EP disclosed
EP-0006735-A1 Secondary amines, their preparation, pharmaceutical compositions containing them and their use BEECHAM GROUP PLC (GB) 1980-01-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160096816-A1 METHOD OF PREPARING INTERMEDIATE OF SALMETEROL HSD3B1, HSD3B2, MSMO1 ADRB2 51/4885BLM 579/4885TDP1 2812/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.