SCHEMBL10884603

SCHEMBL10884603

CC(C)(C)C(N)C(O)c1ccc(O)c(CO)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 10/20 0.56
▸ ADRB1 P08588 2/20 0.56
▸ TSHR P16473 2/20 0.56
▸ NFKB1 P19838 2/20 0.56
▸ HIF1A Q16665 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ TDP1 Q9NUW8 6/20 0.55
▸ PMP22 Q01453 1/20 0.50
▸ KLF10 Q13118 1/20 0.49
▸ KDM4E B2RXH2 5/20 0.45
▸ RECQL P46063 4/20 0.45
▸ MAPT P10636 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ THPO P40225 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ APEX1 P27695 1/20 0.45
▸ MTOR P42345 1/20 0.45

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
SCHEMBL14622394 0.79 ADRB2 (0.54) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL27750307 0.78 TDP1 (0.49) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL15394713 0.77 ADRB2 (0.51) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL10450797 0.75 ADRB2 (0.57) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL22607306 0.75 ADRB2 (0.57) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL14220262 0.75 ADRB2 (0.57) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL11879993 0.74 TDP1 (0.45) ADRB1TSHRNFKB1HIF1ATDP1
SCHEMBL11881114 0.74 TDP1 (0.45) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL21517411 0.74 ADRB2 (0.56) ADRB2ADRB1TSHRNFKB1HIF1A
SCHEMBL10215349 0.73 ADRB2 (0.54) ADRB2ADRB1TSHRNFKB1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115887394-A Preparation method of salbutamol sulfate tablet 北京云鹏鹏程医药科技有限公司 2023-04-04 — — CN disclosed
CN-101366699-B Novel lipid composition aerosol for the controlled release of pharmaceutically active ingredients UNIV HONG KONG BAPTIST 2014-04-16 — — CN disclosed
EP-0110202-B1 PROCESS FOR THE PREPARATION OF PHENYLETHANOL AMINES SIEGFRIED AKTIENGESELLSCHAFT (CH) 1986-10-15 — — EP disclosed
EP-0110202-A2 Process for the preparation of phenylethanol amines SIEGFRIED AKTIENGESELLSCHAFT (CH) 1984-06-13 — — EP disclosed
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