SCHEMBL6958165

SCHEMBL6958165

COc1ccc(CCNC(=S)Nc2ccccn2)c(OC)c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.65
RAB9A P51151 4/20 0.65
ALDH1A1 P00352 4/20 0.65
LMNA P02545 4/20 0.65
MAPT P10636 4/20 0.65
NPC1 O15118 3/20 0.65
NPSR1 Q6W5P4 2/20 0.65
POLB P06746 1/20 0.58
ALOX12 P18054 7/20 0.56
KMT2A Q03164 3/20 0.55
GAA P10253 3/20 0.55
HPGD P15428 1/20 0.55
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 2/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.49
HTT P42858 2/20 0.47
RECQL P46063 1/20 0.47

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
SCHEMBL6955375 0.91 SMN1; SMN2 (0.61) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6954647 0.87 POLB (0.64) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6964982 0.82 ALDH1A1 (0.74) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6962367 0.82 ALDH1A1 (0.69) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6964410 0.80 POLB (0.64) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6957655 0.79 ALDH1A1 (0.61) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6952474 0.79 MEN1 (0.53) SMN1; SMN2ALDH1A1LMNAMAPTALOX12
SCHEMBL6957303 0.79 KDM4E (0.50) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6959563 0.79 POLB (0.59) SMN1; SMN2RAB9AALDH1A1LMNAMAPT
SCHEMBL6958174 0.76 ALDH1A1 (0.67) SMN1; SMN2RAB9AALDH1A1LMNAMAPT

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