SCHEMBL6815214

SCHEMBL6815214

O=C(Nc1ccc(NC(=S)NCCc2cccc(Br)c2)cc1)c1csnn1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.53
MAPT P10636 12/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
RAB9A P51151 4/20 0.50
MEN1 O00255 8/20 0.49
KMT2A Q03164 8/20 0.49
NPC1 O15118 3/20 0.49
GAA P10253 2/20 0.49
ALDH1A1 P00352 5/20 0.48
LMNA P02545 3/20 0.48
THRB P10828 2/20 0.46
ALOX12 P18054 1/20 0.46
TP53 P04637 3/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL6819733 0.89 MAPT (0.64) CNR1MAPTSMN1; SMN2RAB9AMEN1
SCHEMBL6816229 0.89 MAPT (0.59) CNR1MAPTSMN1; SMN2RAB9AMEN1
SCHEMBL6815517 0.88 MAPT (0.49) MAPTSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6815256 0.88 MAPT (0.53) CNR1MAPTSMN1; SMN2RAB9AMEN1
SCHEMBL6815912 0.87 MAPT (0.60) MAPTSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6815254 0.85 MEN1 (0.61) CNR1MAPTSMN1; SMN2RAB9AMEN1
SCHEMBL6811239 0.85 THRB (0.62) CNR1MAPTSMN1; SMN2RAB9AMEN1
SCHEMBL6811640 0.84 MAPT (0.49) MAPTSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6814757 0.84 MAPT (0.48) MAPTSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6810885 0.83 MAPT (0.50) MAPTSMN1; SMN2RAB9AMEN1KMT2A

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-6426355-B1 VIRICIDES; PREVENTION PRODUCTION AMERICAN HOME PRODUCTS 2002-07-30 US disclosed
US-6262090-B1 Aminopyridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION 2001-07-17 US disclosed