SCHEMBL6420959

SCHEMBL6420959

O=c1[nH]c(S)nc2ccsc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.54
RAB9A P51151 2/20 0.54
MAPT P10636 2/20 0.50
PDPK1 O15530 1/20 0.49
PARP1 P09874 1/20 0.49
SPR P35270 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
HTT P42858 2/20 0.45
RXFP1 Q9HBX9 2/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
TDP1 Q9NUW8 2/20 0.43
PDE5A O76074 1/20 0.43
LMNA P02545 1/20 0.42
PSD A5PKW4 1/20 0.42
TSHR P16473 1/20 0.40

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
SCHEMBL17893461 0.78 SMN1; SMN2 (0.54) SMN1; SMN2RAB9AMAPTPDPK1PARP1
SCHEMBL20458014 0.78 SMN1; SMN2 (0.54) SMN1; SMN2RAB9AMAPTPDPK1PARP1
SCHEMBL20458007 0.78 SMN1; SMN2 (0.54) SMN1; SMN2RAB9AMAPTPDPK1PARP1
SCHEMBL5068159 0.78 SMN1; SMN2 (0.54) SMN1; SMN2RAB9AMAPTPDPK1PARP1
SCHEMBL1369682 0.78 SMN1; SMN2 (0.62) SMN1; SMN2RAB9AMAPTPDPK1PARP1
SCHEMBL13461924 0.77 ALDH1A1 (0.54) SMN1; SMN2RAB9AMAPTL3MBTL1CASP3
SCHEMBL18689714 0.74 SMN1; SMN2 (0.50) SMN1; SMN2RAB9AMAPTPDPK1PARP1
SCHEMBL18701479 0.74 SMN1; SMN2 (0.54) SMN1; SMN2RAB9AMAPTPDPK1PARP1
SCHEMBL3985339 0.74 RXFP1 (0.54) SMN1; SMN2RAB9AMAPTL3MBTL1CASP3
SCHEMBL13947840 0.74 HTT (0.59) SMN1; SMN2RAB9AMAPTL3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603881-A2 SUBSTITUTED THIOPHENES WITH ANTIBACTERIAL ACTIVITY Replidyne, Inc. (US) 2005-12-14 EP disclosed
WO-2004078119-A2 SUBSTITUTED THIOPHENES WITH ANTIBACTERIAL ACTIVITY REPLIDYNE INC. (US) 2004-09-16 WO disclosed