SCHEMBL8519506

SCHEMBL8519506

OC(Cl)c1ccccc1Cl.[KH]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.46
ADRB1 P08588 2/20 0.46
AOC3 Q16853 1/20 0.46
TSHR P16473 4/20 0.45
HIF1A Q16665 3/20 0.45
LMNA P02545 2/20 0.45
BLM P54132 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP2C9 P11712 1/20 0.45
KDM4E B2RXH2 1/20 0.45
NR1I2 O75469 1/20 0.45
ABCB11 O95342 1/20 0.45
NR3C1 P04150 1/20 0.45
PGR P06401 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADRA2A P08913 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
MAPT P10636 1/20 0.45
CNR1 P21554 1/20 0.45
SLC6A2 P23975 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
SCHEMBL456765 0.97 ADRB2 (0.47) ADRB2ADRB1AOC3TSHRHIF1A
Phenyl Ethanol SCHEMBL17185911 0.82 ACP3 (0.46) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL11606505 0.81 TSHR (0.50) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL6918732 0.79 ADRB2 (0.48) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL230382 0.79 ADRB2 (0.48) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL29976363 0.79 ADRB2 (0.48) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL4940577 0.78 CYP1A2 (0.54) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL11617245 0.76 TSHR (0.50) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL30848757 0.76 TSHR (0.50) ADRB2ADRB1AOC3TSHRHIF1A
SCHEMBL947512 0.76 TSHR (0.50) ADRB2ADRB1AOC3TSHRHIF1A

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-0927019-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MedLogic Global Corporation (US) 1999-07-07 EP disclosed
WO-1998048768-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MEDLOGIC GLOBAL CORPORATION (US) 1998-11-05 WO disclosed