Sugi Predict

Sugi Predict / Compounds / Salicyl Alcohol

Salicyl Alcohol

Salicyl Alcohol

SCHEMBL3886020

CN(CCOCCCCCCNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12)Cc1cccc(-n2ccc(=O)[nH]c2=O)c1.OCc1ccccc1O

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 20/20 0.59
▸ ADRB1 P08588 17/20 0.59
▸ ADRB3 P13945 3/20 0.59
▸ DRD2 P14416 2/20 0.45
▸ DRD1 P21728 1/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ DRD3 P35462 1/20 0.44

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
SCHEMBL2563823 0.94 ADRB2 (0.56) ADRB2ADRB1ADRB3DRD2
SCHEMBL2565756 0.94 ADRB2 (0.56) ADRB2ADRB1ADRB3DRD2
SCHEMBL2563829 0.94 ADRB2 (0.56) ADRB2ADRB1ADRB3DRD2
SCHEMBL2565650 0.85 ADRB2 (0.48) ADRB2ADRB1ADRB3DRD2DRD1
SCHEMBL2565645 0.85 ADRB2 (0.48) ADRB2ADRB1ADRB3DRD2DRD1
SCHEMBL2563154 0.82 ADRB2 (0.46) ADRB2ADRB1ADRB3DRD2DRD1
SCHEMBL2567509 0.81 ADRB2 (0.49) ADRB2ADRB1DRD2DRD1DRD4
SCHEMBL2564506 0.81 ADRB2 (0.54) ADRB2ADRB1DRD2
SCHEMBL2567506 0.81 ADRB2 (0.48) ADRB2ADRB1DRD2DRD1DRD4
SCHEMBL2578225 0.80 ADRB2 (0.60) ADRB2ADRB1

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-2013183-A1 DERIVATIVES OF 4-(2-AMINO-1-HYDROXIETHYL)PHENOL AS AGONISTS OF THE BETA2 ADRENERGIC RECEPTOR Laboratorios Almirall, S.A. (ES) 2009-01-14 — — EP claimed
WO-2007124898-A1 DERIVATIVES OF 4-(2-AMINO-1-HYDROXIETHYL)PHENOL AS AGONISTS OF THE β2 ADRENERGIC RECEPTOR LABORATORIOS, ALMIRALL S.A. (ES) 2007-11-08 — — WO claimed