Benomyl

Benomyl

SCHEMBL8819362

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

nearest known ligand 0.80

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.80
▸ ALDH1A1 P00352 2/20 0.80
▸ ASAH1 Q13510 8/20 0.49
▸ KMT2A Q03164 3/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ IRAK4 Q9NWZ3 1/20 0.39
▸ RAB9A P51151 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ SAE1 Q9UBE0 1/20 0.38
▸ UBA2 Q9UBT2 1/20 0.38
▸ CNR2 P34972 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ MCHR1 Q99705 1/20 0.36

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
Benomyl SCHEMBL15681 0.89 TSHR (1.00) TSHRALDH1A1ASAH1KMT2ANPSR1
Benomyl SCHEMBL8379451 0.89 TSHR (1.00) TSHRALDH1A1ASAH1KMT2ANPSR1
SCHEMBL1324358 0.89 ASAH1 (0.60) TSHRALDH1A1ASAH1LMNATP53
Benomyl SCHEMBL29379464 0.89 TSHR (1.00) TSHRALDH1A1ASAH1KMT2ANPSR1
Benomyl SCHEMBL28721488 0.88 TSHR (0.94) TSHRALDH1A1ASAH1KMT2ANPSR1
Benomyl SCHEMBL27841656 0.88 TSHR (0.94) TSHRALDH1A1ASAH1KMT2ANPSR1
Benomyl SCHEMBL3962065 0.88 TSHR (0.98) TSHRALDH1A1ASAH1KMT2ANPSR1
Benomyl SCHEMBL6912357 0.87 TSHR (0.92) TSHRALDH1A1ASAH1KMT2ANPSR1
Thiophanate Methyl SCHEMBL7925889 0.86 ALDH1A1 (0.58) TSHRALDH1A1ASAH1KMT2ALMNA
Benomyl SCHEMBL23632884 0.85 TSHR (0.92) TSHRALDH1A1ASAH1KMT2ANPSR1

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
US-5670450-A APPLYING AS A MIXTURE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1997-09-23 — — US disclosed
WO-1997024928-A1 INHIBITING INDUCED PHYTOTOXICITY IN HERBICIDES ON RICE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1997-07-17 — — WO disclosed
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