SCHEMBL6958266

SCHEMBL6958266

CC(Cc1ccc[nH]1)NC(=S)Nc1ccc(Cl)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.49
RAB9A P51151 4/20 0.49
NPC1 O15118 3/20 0.49
HPGD P15428 2/20 0.49
THRB P10828 2/20 0.49
MAPT P10636 4/20 0.46
ALDH1A1 P00352 4/20 0.45
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
HTT P42858 4/20 0.43
NPSR1 Q6W5P4 2/20 0.43
LMNA P02545 2/20 0.43
LTC4S Q16873 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MAPK1 P28482 2/20 0.41
PTK2 Q05397 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GLA P06280 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL6960348 0.74 LMNA (0.46) L3MBTL1RAB9ANPC1HPGDMAPT
SCHEMBL8182582 0.73 RAB9A (0.49) L3MBTL1RAB9ANPC1HPGDTHRB
SCHEMBL6953534 0.69 RAB9A (0.50) L3MBTL1RAB9ANPC1HPGDTHRB
SCHEMBL6805138 0.67 RAB9A (0.50) L3MBTL1RAB9ANPC1HPGDTHRB
SCHEMBL11485957 0.67 L3MBTL1 (0.59) L3MBTL1RAB9ANPC1HPGDTHRB
SCHEMBL11373359 0.66 RAB9A (0.70) L3MBTL1RAB9ANPC1HPGDTHRB
SCHEMBL6963788 0.64 RAB9A (0.54) RAB9ANPC1THRBALDH1A1KMT2A
SCHEMBL2986491 0.63 TAAR1 (0.48)
SCHEMBL8495125 0.63 GAA (0.58) L3MBTL1RAB9ANPC1HPGDTHRB
SCHEMBL11396235 0.63 L3MBTL1 (0.51) L3MBTL1RAB9ANPC1HPGDTHRB

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