Thiophene

Thiophene

SCHEMBL29976406

C=Cc1cccnc1C.c1ccsc1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TRIM24 O15164 1/20 0.32
▸ TRIM33 Q9UPN9 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ P2RX7 Q99572 1/20 0.31
▸ NOS3 P29474 1/20 0.31
▸ NOS1 P29475 1/20 0.31
▸ NOS2 P35228 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL935465 0.89 — —
Diphenylamine SCHEMBL28928723 0.88 ALDH1A1 (0.38) ALDH1A1NPC1L3MBTL1
Hydrochloric Acid SCHEMBL4201170 0.87 ALDH1A1 (0.37) TRIM24TRIM33ALDH1A1P2RX7NOS3
Formic Acid Methyl Ester SCHEMBL28016660 0.77 TRIM24 (0.38) TRIM24TRIM33ALDH1A1P2RX7NPC1
SCHEMBL11173012 0.73 TRIM24 (0.35) TRIM24TRIM33ALDH1A1P2RX7NOS3
SCHEMBL9477342 0.72 — —
SCHEMBL14677805 0.72 — —
SCHEMBL28007124 0.71 P2RX7 (0.36) TRIM24TRIM33ALDH1A1P2RX7NPC1
SCHEMBL14511529 0.70 NFE2L2 (0.34) TRIM24TRIM33ALDH1A1P2RX7NOS3
SCHEMBL6631270 0.70 — —

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
CN-113698425-B Cell dual-targeting multi-photon absorption europium complex/thiophene pyridinium hybrid material and preparation method and application thereof 安徽大学 2022-10-04 — — CN disclosed
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