SCHEMBL6960348

SCHEMBL6960348

CC(Cc1ccc[nH]1)NC(=S)Nc1nccs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.46
RAB9A P51151 3/20 0.46
ALDH1A1 P00352 3/20 0.46
GAA P10253 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HTT P42858 3/20 0.46
NPC1 O15118 2/20 0.46
NFKB1 P19838 2/20 0.46
MAPK1 P28482 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
PKM P14618 1/20 0.46
CYP2C19 P33261 1/20 0.46
THPO P40225 1/20 0.46
MTOR P42345 1/20 0.46

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
SCHEMBL6959508 0.78 HPGD (0.49) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL6958266 0.74 L3MBTL1 (0.49) LMNARAB9AALDH1A1SMN1; SMN2HTT
SCHEMBL6953508 0.72 HTT (0.45) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL6284560 0.70 NPC1 (0.56) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL6281076 0.70 NPC1 (0.52) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL8687284 0.69 RAB9A (0.58) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL6960135 0.69 HSPA1A (0.60) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL6960139 0.69 HSPA1A (0.60) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL6281340 0.68 NPC1 (0.57) LMNARAB9AALDH1A1GAASMN1; SMN2
SCHEMBL6284442 0.68 NPC1 (0.57) LMNARAB9AALDH1A1GAASMN1; 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 5 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