Thiophanate Methyl

Thiophanate Methyl

SCHEMBL7925889

CCCCNC(=O)n1c(N(C)C(=O)O)nc2ccccc21.COC(=O)NC(=S)Nc1ccccc1NC(=S)NC(=O)OC

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.58
▸ TSHR P16473 2/20 0.58
▸ ASAH1 Q13510 7/20 0.46
▸ LMNA P02545 3/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HTT P42858 2/20 0.36
▸ ALOX12 P18054 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CNR2 P34972 1/20 0.35
▸ GAA P10253 1/20 0.35

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
SCHEMBL1324358 0.86 ASAH1 (0.60) ALDH1A1TSHRASAH1LMNASMN1; SMN2
Thiophanate Methyl SCHEMBL10423105 0.86 ALDH1A1 (0.80) ALDH1A1TSHRASAH1LMNAHPGD
Benomyl SCHEMBL8819362 0.86 TSHR (0.80) ALDH1A1TSHRASAH1LMNAHSD17B10
SCHEMBL9578772 0.82 ASAH1 (0.67) ALDH1A1TSHRASAH1LMNAHTT
Thiophanate SCHEMBL20495504 0.81 ALDH1A1 (0.74) ALDH1A1TSHRASAH1LMNAHPGD
SCHEMBL9579226 0.80 ASAH1 (0.53) ALDH1A1TSHRASAH1HTTKMT2A
Benzimidazole SCHEMBL10781773 0.77 ASAH1 (0.49) ALDH1A1TSHRASAH1LMNAHPGD
SCHEMBL10551003 0.76 ASAH1 (0.47) ALDH1A1TSHRASAH1KMT2ARAB9A
SCHEMBL11678871 0.76 ALDH1A1 (0.70) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL11635628 0.75 ALDH1A1 (0.71) ALDH1A1TSHRASAH1LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888283-B1 WIDELY-BRIDGED ALCOHOL POLYETHOXYLATES AND THEIR USE ALBEMARLE CORP (US) 2001-01-03 — — EP disclosed
EP-0888283-A1 WIDELY-BRIDGED ALCOHOL POLYETHOXYLATES AND THEIR USE ALBEMARLE CORPORATION (US) 1999-01-07 — — EP disclosed
WO-1998014422-A1 WIDELY-BRIDGED ALCOHOL POLYETHOXYLATES AND THEIR USE ALBEMARLE CORPORATION (US) 1998-04-09 — — WO disclosed
Send feedback