SCHEMBL8256708

SCHEMBL8256708

Cc1ccccc1C(=S)c1ccccc1C

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
ACHE P22303 1/20 0.47
ALDH1A1 P00352 3/20 0.43
POLB P06746 2/20 0.43
HPGD P15428 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL11757827 0.85 ALDH1A1 (0.49) ALDH1A1POLBHPGDMAPTERCC5
SCHEMBL8891362 0.85 ALDH1A1 (0.56) ALDH1A1POLBHPGDERCC5FEN1
SCHEMBL11757375 0.82 AKR1C3 (0.44) ALDH1A1HPGDMAPTSMN1; SMN2NPC1
SCHEMBL31613189 0.82 AKR1C3 (0.44) ALDH1A1HPGDMAPTSMN1; SMN2NPC1
SCHEMBL3972685 0.81 TSHR (0.45) TSHRACHEALDH1A1POLBHPGD
SCHEMBL31135508 0.81 HPGD (0.47) TSHRACHEALDH1A1POLBHPGD
SCHEMBL1029641 0.81 HPGD (0.47) TSHRACHEALDH1A1POLBHPGD
SCHEMBL3281848 0.80 MYC (0.36) ALDH1A1POLBHPGDGAAMAPT
SCHEMBL1127934 0.80 ALDH1A1 (0.38) ALDH1A1POLBHPGDGAAMAPT
SCHEMBL5426379 0.79 TSHR (0.43) TSHRACHEALDH1A1POLBHPGD

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-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 US disclosed