SCHEMBL7101433

SCHEMBL7101433

FC(CBr)COc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
SCN4A P35499 2/20 0.47
MAOA P21397 1/20 0.44
PTGS1 P23219 1/20 0.44
KCNA3 P22001 1/20 0.43
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
CYP2D6 P10635 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL27864161 0.82 LMNA (0.47) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL27548952 0.81 LMNA (0.50) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL17425093 0.79 LMNA (0.53) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL28527689 0.78 LMNA (0.52) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL14954600 0.78 LMNA (0.56) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL9229780 0.78 LMNA (0.56) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL6651790 0.78 LMNA (0.47) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL9816273 0.77 LMNA (0.50) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL3824504 0.76 LMNA (0.46) LMNASCN4AMAOAPTGS1KCNA3
SCHEMBL28025665 0.76 LMNA (0.50) LMNASCN4AMAOAPTGS1KCNA3

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
WO-2003095441-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2003-11-20 WO disclosed