Thiophene

Thiophene

SCHEMBL27776643

CCCCCc1cc2ccccc2oc1=O.c1ccsc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.53
MAOA P21397 3/20 0.53
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
ADAM17 P78536 1/20 0.49
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 2/20 0.43
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
APAF1 O14727 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL45450 0.92 MAOB (0.61) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL6136580 0.90 MAOB (0.59) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL21385208 0.90 MAOB (0.59) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL28535264 0.90 MAOB (0.59) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL3506842 0.87 MAOB (0.62) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL11092927 0.81 MAOB (0.66) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL6136579 0.78 MAOB (0.47) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL27625488 0.78 MMP2 (0.67) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL293427 0.77 MMP2 (0.56) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL30594160 0.76 MAOB (0.67) MAOBMAOAMMP2MMP9ADAM17

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
CN-101674797-B Adhesive for teeth-straightening members TOKUYAMA DENTAL CORP 2012-11-14 CN disclosed
CN-101674797-A Adhesive for teeth-straightening members UNIV NIHON 2010-03-17 CN disclosed