SCHEMBL7981202

SCHEMBL7981202

NC(=O)c1ccccc1NC(=S)Nc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.56
KDR P35968 1/20 0.54
LMNA P02545 2/20 0.53
ALDH1A1 P00352 4/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
TRPV1 Q8NER1 7/20 0.53
MAPT P10636 3/20 0.51
GRM4 Q14833 1/20 0.51
TP53 P04637 1/20 0.50
PDK1 Q15118 1/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KCNJ5 P48544 1/20 0.50
KCNJ3 P48549 1/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL7981203 0.83 LMNA (0.57) KDRLMNAALDH1A1KMT2AMEN1
SCHEMBL6815777 0.82 KDR (0.61) KDRLMNAALDH1A1KMT2AMEN1
SCHEMBL4555026 0.81 LMNA (0.75) KDRLMNAALDH1A1KMT2AMEN1
SCHEMBL6815840 0.79 GRM4 (0.57) KDRLMNAALDH1A1KMT2AMEN1
SCHEMBL7989797 0.78 KMT2A (0.76) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL4555072 0.77 LMNA (0.69) KDRLMNAALDH1A1KMT2AMEN1
SCHEMBL6815322 0.76 LMNA (0.65) KDRLMNAALDH1A1KMT2AMEN1
SCHEMBL6815784 0.76 LMNA (0.64) KDRLMNAALDH1A1KMT2AMEN1
SCHEMBL5950186 0.76 KDR (0.60) MAPK14KDRALDH1A1KMT2AMEN1
SCHEMBL4555515 0.76 LMNA (0.68) KDRLMNAALDH1A1KMT2AMEN1

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