SCHEMBL7915018

SCHEMBL7915018

FC(F)(F)c1cccc(CCNC(=S)NC2=CC[CH]C=C2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.48
CNR1 P21554 1/20 0.45
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
MAPT P10636 5/20 0.44
HPGD P15428 3/20 0.44
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HTT P42858 3/20 0.41
ALOX12 P18054 2/20 0.41
KDM4E B2RXH2 1/20 0.41
XBP1 P17861 1/20 0.41
NAMPT P43490 1/20 0.41
ALDH1A1 P00352 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
GAA P10253 1/20 0.39
BLM P54132 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL7661828 0.89 TACR1 (0.39) LMNAMEN1KMT2AMAPTNPC1
SCHEMBL7651952 0.86 KMT2A (0.49) LMNACNR1MEN1KMT2AMAPT
SCHEMBL7642827 0.85 ALDH1A1 (0.53) LMNACNR1MEN1KMT2AMAPT
SCHEMBL7641142 0.83 NPC1 (0.58) LMNACNR1MEN1KMT2AMAPT
SCHEMBL7637941 0.80 GAA (0.48) LMNACNR1MEN1KMT2AMAPT
SCHEMBL7914787 0.79 MYC (0.48) LMNAMEN1KMT2AMAPTHPGD
SCHEMBL7640046 0.79 MAPT (0.58) LMNAMEN1KMT2AMAPTHPGD
SCHEMBL7594773 0.78 MAPT (0.52) LMNAMEN1KMT2AMAPTNPC1
SCHEMBL14433774 0.76 NPC1 (0.65) LMNACNR1MEN1KMT2AMAPT
SCHEMBL7599729 0.76 RAB9A (0.51) LMNACNR1MEN1KMT2AMAPT

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
US-6207715-B1 USEFUL IN THERAPY OF DISEASES ASSOCIATED WITH HERPES VIRUSES INCLUDING HUMAN CYTOMEGALOVIRUS, HERPES SIMPLEX VIRUSES, EPSTEIN-BARR VIRUS, VARICELLA-ZOSTER VIRUS, HUMAN HERPESVIRUSES-6 AND -7, AND KAPOSI HERPES VIRUS AMERICAN HOME PRODUCTS CORPORATION 2001-03-27 US disclosed