SCHEMBL6926893

SCHEMBL6926893

CCCCNC(=O)n1c(NC(=O)O)nc2ccccc21

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.79
ALDH1A1 P00352 1/20 0.79
ASAH1 Q13510 10/20 0.62
NPSR1 Q6W5P4 3/20 0.50
KDM4E B2RXH2 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 2/20 0.50
TP53 P04637 2/20 0.50
USP2 O75604 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MCHR1 Q99705 1/20 0.48
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
RAB9A P51151 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL5570257 0.93 TSHR (0.67) TSHRALDH1A1ASAH1NPSR1KDM4E
SCHEMBL675169 0.90 TSHR (0.79) TSHRALDH1A1ASAH1NPSR1KDM4E
SCHEMBL7102687 0.89 TSHR (0.83) TSHRALDH1A1ASAH1NPSR1KDM4E
Benomyl SCHEMBL15681 0.88 TSHR (1.00) TSHRALDH1A1ASAH1NPSR1KDM4E
Benomyl SCHEMBL8379451 0.88 TSHR (1.00) TSHRALDH1A1ASAH1NPSR1KDM4E
Benomyl SCHEMBL29379464 0.88 TSHR (1.00) TSHRALDH1A1ASAH1NPSR1KDM4E
SCHEMBL11884864 0.88 TSHR (0.74) TSHRALDH1A1ASAH1NPSR1KDM4E
Benomyl SCHEMBL28721488 0.88 TSHR (0.94) TSHRALDH1A1ASAH1NPSR1KDM4E
Benomyl SCHEMBL27841656 0.88 TSHR (0.94) TSHRALDH1A1ASAH1NPSR1KDM4E
SCHEMBL28073618 0.87 TSHR (0.67) TSHRALDH1A1ASAH1NPSR1KDM4E

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 117 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0984688-B1 FUNGICIDAL MIXTURES BASF AG (DE) 2003-07-23 EP claimed
EP-1102534-B1 METHOD FOR TREATING WOOD AGAINST THE ATTACK OF HARMFUL FUNGI WOLMAN GMBH DR (DE) 2003-05-02 EP claimed
EP-1041884-B1 FUNGICIDE MIXTURES BASED ON PYRIDIN CARBOXAMIDES AND BENZIMIDAZOLES OR THE PRECURSORS THEREOF BASF AG (DE) 2002-09-25 EP claimed
EP-1111994-B1 USE OF DERIVATIVES OF METHYLENE-BIS-OXAZOLIDINE AND COMPOSITIONS THEREOF AIR LIQUIDE SANTE INT (FR) 2002-07-17 EP claimed
EP-0609099-B1 Antimicrobial and antifungal compositions comprising silicon-compounds, and their use in agriculture and horticulture SANKYO CO (JP) 1997-03-26 EP claimed
EP-0127990-B1 FUNGICIDAL ANILINE DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-05-06 EP claimed
EP-0116409-B1 FUNGICIDAL ANILINE DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-03-13 EP claimed
EP-0230773-B1 DIPROPARGYLOXYBENZENE COMPOUNDS AND THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-05-23 EP claimed
EP-0125901-B1 FUNGICIDAL ANILINE DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-02-08 EP claimed
EP-0117024-B1 FUNGICIDAL ANILINE DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-30 EP claimed
EP-0100190-B1 FUNGICIDAL N-PHENYLCARBAMATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-10-05 EP claimed
EP-0100615-B1 FUNGICIDAL ANILIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-09-23 EP claimed
EP-0092961-B1 A FUNGICIDAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-07-30 EP claimed
EP-0063905-B1 FUNGICIDAL N-PHENYLCARBAMATES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-08-14 EP claimed
EP-0078663-B1 FUNGICIDAL N-PHENYLCARBAMATES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-04-17 EP claimed
US-12036192-B2 Combination treatments for opioid crisis PRESTI MICHAEL (US) 2024-07-16 US disclosed
CN-118302524-A High molecular weight modified dsRNA compositions 纳诺索尔公司 2024-07-05 CN disclosed
US-4055661-A Miticidal and aphicidal method utilizing 2-higher alkyl-3-hydroxy-1,4-naphthoquinone carboxylic acid esters E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-10-25 US disclosed
US-4053634-A MITICIDAL AND APHICIDAL METHOD UTILIZING 2-HIGHER ALKYL-3-HYDROXY-1,4-NAPHTHOQUINONE CARBOXYLIC ACID ESTERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-10-11 US disclosed
US-3764686-A MIXTURES OF 1-(BUTYLACARBAMOYL)-2-BENZIMIDAZOLECARBAMIC ACID, METHYL ESTER AND ETHYLENEBISDITHTOCARBAMIC ACID SALTS AS FOLIAR FUNGICIDES DU PONT 1973-10-09 US disclosed