SCHEMBL6815947

SCHEMBL6815947

O=C(Nc1ccc(NC(=S)NCCc2cc(F)cc(C(F)(F)F)c2)cc1)c1csnn1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.57
KMT2A Q03164 7/20 0.57
MEN1 O00255 6/20 0.57
ALDH1A1 P00352 5/20 0.57
LMNA P02545 2/20 0.44
TP53 P04637 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42
CNR1 P21554 1/20 0.42
THRB P10828 1/20 0.40
CDK1 P06493 1/20 0.40
NAMPT P43490 1/20 0.40
GAA P10253 2/20 0.39
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 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
SCHEMBL6816271 0.94 MAPT (0.61) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6810885 0.91 MAPT (0.50) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6816007 0.91 MAPT (0.59) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6815254 0.89 MEN1 (0.61) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6811235 0.88 MAPT (0.53) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6815670 0.88 MAPT (0.68) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6815256 0.85 MAPT (0.53) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6814080 0.84 MAPT (0.63) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6814990 0.84 MAPT (0.60) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL6815611 0.83 MAPT (0.59) MAPTKMT2AMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137632-B1 THIOUREA INHIBITORS OF HERPES VIRUSES WYETH CORP (US) 2004-07-28 EP disclosed
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