SCHEMBL6815587

SCHEMBL6815587

CC(C)Cc1cc(NC(=S)Nc2ccc(NC(=O)c3csnn3)cc2)cc(C(F)(F)F)c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.59
ALDH1A1 P00352 5/20 0.59
MEN1 O00255 5/20 0.59
KMT2A Q03164 5/20 0.59
TP53 P04637 4/20 0.51
HPGD P15428 2/20 0.51
NPC1 O15118 1/20 0.51
POLB P06746 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
LMNA P02545 3/20 0.48
TRPA1 O75762 3/20 0.46
THRB P10828 2/20 0.42
KDR P35968 1/20 0.42
JUN P05412 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
MMP2 P08253 1/20 0.41

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
SCHEMBL6811101 0.92 MAPT (0.56) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL7979004 0.88 MAPT (0.71) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL6815562 0.84 MAPT (0.54) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL6814745 0.83 MAPT (0.55) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL6815350 0.83 MAPT (0.64) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL6811902 0.82 MAPT (0.61) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL6819388 0.82 MAPT (0.61) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL6814080 0.82 MAPT (0.63) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL6815615 0.81 ALDH1A1 (0.81) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL7745937 0.80 MAPT (0.61) MAPTALDH1A1MEN1KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137645-B1 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP WYETH CORP (US) 2004-05-26 EP disclosed
US-6555561-B2 N-(5-((((5-Chloro-2,4-dimethoxyphenyl)amino)thioxomethyl)-amino)-2 -pyridinyl)-2-methylbenzamide, for example; inhibiting replication of a herpes virus WYETH 2003-04-29 US disclosed
US-6262090-B1 Aminopyridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION 2001-07-17 US disclosed
US-6201013-B1 INOSINE MONOPHOSPHATE DEHYDROGENASE (IMPDH) INHIBITOR; SIDE EFFECT REDUCTION, NON-DRUG RESISTANT AMERICAN HOME PRODUCTS CORPORATION 2001-03-13 US disclosed