Phenylpropanol

Phenylpropanol

SCHEMBL5690153

CC(OC(=O)Cc1ccccc1)c1ccccc1.CCC(O)c1ccccc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
LMNA P02545 1/20 0.54
HCAR2 Q8TDS4 1/20 0.43
LPAR1 Q92633 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
KLK7 P49862 7/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
PAM P19021 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CNR2 P34972 1/20 0.40
GAA P10253 1/20 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
SCHEMBL3391481 0.89 TSHR (0.71) TSHRHCAR2LPAR1CRHBPCRHR2
SCHEMBL112612 0.89 TSHR (0.71) TSHRHCAR2LPAR1CRHBPCRHR2
SCHEMBL13046507 0.89 TSHR (0.71) TSHRHCAR2LPAR1CRHBPCRHR2
Formic Acid SCHEMBL11016171 0.84 TSHR (0.63) TSHRHCAR2LPAR1CRHBPCRHR2
SCHEMBL14088113 0.83 TSHR (0.54) TSHRHCAR2LPAR1KLK7ALDH1A1
SCHEMBL3395745 0.79 KLK7 (0.61) TSHRKLK7ALDH1A1L3MBTL1CNR2
SCHEMBL28312880 0.78 TSHR (0.68) TSHRKLK7ALDH1A1MAPK1L3MBTL1
SCHEMBL3395537 0.77 TSHR (0.62) TSHRCRHBPCRHR2KLK7ALDH1A1
SCHEMBL3393812 0.77 TSHR (0.62) TSHRCRHBPCRHR2KLK7ALDH1A1
SCHEMBL14088117 0.77 TSHR (0.50) TSHRHCAR2LPAR1CRHBPCRHR2

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-1654197-A1 CARRIER BASED ON GRANULES PRODUCED FROM PYROGENICALLY PREPARED SILICON DIOXIDES Degussa AG (DE) 2006-05-10 EP disclosed
WO-2005016823-A1 CARRIER BASED ON GRANULES PRODUCED FROM PYROGENICALLY PREPARED SILICON DIOXIDES DEGUSSA AG (DE) 2005-02-24 WO disclosed