SCHEMBL6816007

SCHEMBL6816007

O=C(Nc1ccc(NC(=S)NCc2cc(F)cc(C(F)(F)F)c2)cc1)c1csnn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.59
MEN1 O00255 7/20 0.59
KMT2A Q03164 7/20 0.59
ALDH1A1 P00352 6/20 0.59
NAMPT P43490 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.47
MYC P01106 1/20 0.46
MAX P61244 1/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MTOR P42345 2/20 0.44
TP53 P04637 3/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
HTT P42858 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL6814080 0.94 MAPT (0.63) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6819280 0.91 LMNA (0.52) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6815947 0.91 MAPT (0.57) MAPTMEN1KMT2AALDH1A1NAMPT
SCHEMBL6819388 0.88 MAPT (0.61) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6815844 0.88 MEN1 (0.63) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6814058 0.87 MAPT (0.55) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6816400 0.85 HDAC1 (0.56) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6816271 0.84 MAPT (0.61) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7074207 0.84 MEN1 (0.53) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6814993 0.84 MEN1 (0.58) MAPTMEN1KMT2AALDH1A1SMN1; SMN2

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 8 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-6335350-B1 VARICELLA-ZOSTER, HUMAN CYTOMEGALO, EPSTEIN-BARR AND KAPOSI HERPESVIRUS TREATMENT AMERICAN HOME PRODUCTS CORPORATION 2002-01-01 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
US-6166028-A Diaminopuridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION (US) 2000-12-26 US disclosed