SCHEMBL8893941

SCHEMBL8893941

COc1ccc2nc(NC(=S)NCCc3ccccc3)sc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.65
ALDH1A1 P00352 4/20 0.65
HPGD P15428 3/20 0.65
NPC1 O15118 5/20 0.62
RAB9A P51151 5/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
SCD O00767 3/20 0.60
BCHE P06276 1/20 0.60
ACHE P22303 1/20 0.60
CSNK1D P48730 3/20 0.60
GAA P10253 1/20 0.58
KMT2A Q03164 6/20 0.57
MEN1 O00255 5/20 0.57
NFKB1 P19838 3/20 0.57
NFKB2 Q00653 3/20 0.57
RELA Q04206 3/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 2/20 0.57
MPI P34949 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL8891868 0.90 MAPT (0.81) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL6958936 0.87 LMNA (0.57) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL6956229 0.86 NPC1 (0.56) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL6951823 0.83 RAB9A (0.64) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL6958863 0.82 ALDH1A1 (0.53) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL10807219 0.82 NPC1 (0.74) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL2791137 0.81 NPC1 (0.65) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL16553901 0.81 MAPT (0.76) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6963999 0.81 NPC1 (0.55) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL6952703 0.81 NPC1 (0.58) MAPTALDH1A1HPGDNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5593993-A VIRICIDES FOR HTLV TREATMENT OF AIDS MEDIVIR AB (SE) 1997-01-14 US disclosed