SCHEMBL6964189

SCHEMBL6964189

Cc1cccc(CCNC(=S)Nc2nc3ccccc3[nH]2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
RAB9A P51151 4/20 0.50
NPC1 O15118 3/20 0.50
MAPT P10636 4/20 0.49
ALOX12 P18054 3/20 0.49
ALDH1A1 P00352 5/20 0.49
MAPK1 P28482 2/20 0.49
HSD17B10 Q99714 1/20 0.49
KDM4E B2RXH2 3/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
PKM P14618 4/20 0.48
KLF5 Q13887 2/20 0.48
OPRK1 P41145 1/20 0.48
LMNA P02545 4/20 0.48
HTT P42858 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
LPAR2 Q9HBW0 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL6956095 0.87 ALDH1A1 (0.60) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6963001 0.87 NPC1 (0.57) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6952296 0.87 NPC1 (0.57) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6961507 0.86 KMT2A (0.67) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6950923 0.84 MAPT (0.50) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6957955 0.82 KDM4E (0.53) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6958138 0.81 NPC1 (0.48) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6955189 0.81 KDM4E (0.63) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6957937 0.80 RAB9A (0.66) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6953252 0.79 ALDH1A1 (0.49) MEN1KMT2ARAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0540143-B1 Compounds and methods for inhibition of HIV and related viruses MEDIVIR AB (SE) 2003-02-05 EP disclosed
US-5714503-A Compounds and methods for inhibition of HIV and related viruses MEDIVIR AB (SE) 1998-02-03 US disclosed
US-5658907-A THIOUREA VIRICIDES MEDIVIR A/B (SE) 1997-08-19 US disclosed
US-5593993-A VIRICIDES FOR HTLV TREATMENT OF AIDS MEDIVIR AB (SE) 1997-01-14 US disclosed
EP-0540143-A2 Compounds and methods for inhibition of HIV and related viruses Medivir Aktiebolag (SE) 1993-05-05 EP disclosed
WO-1993003022-A1 COMPOUNDS AND METHODS FOR INHIBITION OF HIV AND RELATED VIRUSES MEDIVIR AB (SE) 1993-02-18 WO disclosed