SCHEMBL7558433

SCHEMBL7558433

C#COc1ccccc1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.38
RAB9A P51151 4/20 0.33
LMNA P02545 3/20 0.33
NPC1 O15118 3/20 0.33
ALDH1A1 P00352 2/20 0.33
GRM4 Q14833 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTR1A P08908 2/20 0.33
ADRA2A P08913 2/20 0.33
ADRA2B P18089 2/20 0.33
ADRA2C P18825 2/20 0.33
PYCR1 P32322 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP1A2 P05177 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.32
IDO1 P14902 1/20 0.31

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
SCHEMBL9501918 0.82
SCHEMBL1191549 0.76 HTR7 (0.38) HTR7RAB9ALMNANPC1ALDH1A1
SCHEMBL8848905 0.76 LMNA (0.40) HTR7RAB9ALMNANPC1ALDH1A1
SCHEMBL9501926 0.74 HTR7 (0.37) HTR7RAB9ALMNANPC1ALDH1A1
SCHEMBL8207291 0.73 LMNA (0.43) LMNAALDH1A1SMN1; SMN2L3MBTL1MAPT
SCHEMBL7553909 0.73 MAPK1 (0.58) RAB9ALMNANPC1ALDH1A1SMN1; SMN2
SCHEMBL30692445 0.73 HTR7 (0.40) HTR7RAB9ALMNANPC1ALDH1A1
SCHEMBL8975558 0.71 TSHR (0.43) RAB9ANPC1ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL6219566 0.71 L3MBTL1 (0.38) ALDH1A1HTR1AL3MBTL1CYP1A2CYP2C9
SCHEMBL6221752 0.71 CA1 (0.62) LMNAALDH1A1SMN1; SMN2ADRA2BL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0735062-B1 ACTINIC-RADIATION-CURABLE COMPOSITION AND LENS SHEET MITSUBISHI RAYON CO (JP) 2002-01-30 EP claimed