SCHEMBL7983000

SCHEMBL7983000

Cc1cc([AsH2])ccc1NC(=O)c1ccccc1F

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
MEN1 O00255 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
KCNMA1 Q12791 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
KDM4E B2RXH2 4/20 0.49
POLB P06746 1/20 0.49
ALDH1A1 P00352 3/20 0.49
MAPT P10636 1/20 0.49
PKM P14618 1/20 0.49
GLA P06280 1/20 0.49
GAA P10253 2/20 0.49
KCNH2 Q12809 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
CNR2 P34972 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL6814841 0.83 MAPT (0.65) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL30608029 0.81 MAPT (0.56) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL18083709 0.81 CNR2 (0.49) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL7784373 0.80 MAPT (0.54) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL4243563 0.80 KLK1 (0.51) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL31425031 0.80 TRPV1 (0.56) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL4250927 0.80 ALDH1A1 (0.64) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL6816754 0.79 MAPT (0.71) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL26066071 0.77 LMNA (0.61) KMT2AMEN1TDP1KCNMA1SMN1; SMN2
SCHEMBL21870338 0.76 ALDH1A1 (0.64) KMT2AMEN1TDP1SMN1; SMN2KDM4E

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-6271236-B1 PHENYL UREAS/THIOUREAS AS INHIBITORS OF INOSINE MONOPHOSPHATE DEHYDROGENASE ENZYME, USEFUL IN TREATING HUMAN CYTOMEGALOVIRUS, HERPES SIMPLEX VIRUSES, EPSTEIN-BARR VIRUS, AND VARICELLA-ZOSTER VIRUS WYETH 2001-08-07 US disclosed