SCHEMBL6819225

SCHEMBL6819225

O=C(Nc1ccc(NC(=S)NCc2ccccc2F)cc1)c1csnn1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.61
MEN1 O00255 8/20 0.61
KMT2A Q03164 8/20 0.61
LMNA P02545 5/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
PKM P14618 1/20 0.61
CRHBP P24387 1/20 0.61
CRHR2 Q13324 1/20 0.61
HDAC1 Q13547 1/20 0.56
ALDH1A1 P00352 6/20 0.55
TP53 P04637 3/20 0.49
HPGD P15428 2/20 0.49
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.49
RAB9A P51151 1/20 0.49
HTT P42858 1/20 0.47
THRB P10828 1/20 0.44
NAMPT P43490 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
SCHEMBL6814899 0.89 MAPT (0.56) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6811089 0.88 LMNA (0.59) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6815597 0.85 MAPT (0.61) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6814650 0.84 ALDH1A1 (0.61) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6816140 0.84 MAPT (0.63) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6814993 0.83 MEN1 (0.58) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6819815 0.83 MAPT (0.50) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6819280 0.82 LMNA (0.52) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6814574 0.81 ALDH1A1 (0.60) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6815402 0.81 MEN1 (0.51) MAPTMEN1KMT2ALMNASMN1; 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 3 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-6426355-B1 VIRICIDES; PREVENTION PRODUCTION AMERICAN HOME PRODUCTS 2002-07-30 US disclosed