SCHEMBL8103907

SCHEMBL8103907

Cc1cc(C(C)C)cc(N(C)C(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.39
FABP4 P15090 2/20 0.39
KDM4E B2RXH2 3/20 0.37
TSPO P30536 2/20 0.35
ALDH1A1 P00352 2/20 0.33
POLB P06746 2/20 0.33
TPMT P51580 1/20 0.32
TACR1 P25103 1/20 0.32
EIF4A3 P38919 2/20 0.32
POLQ O75417 1/20 0.32
LMNA P02545 2/20 0.31
RECQL P46063 1/20 0.31
NOTUM Q6P988 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KMT2A Q03164 1/20 0.31
FABP5 Q01469 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
SCHEMBL11508626 0.89 FABP3 (0.44) FABP3FABP4KDM4EALDH1A1POLB
SCHEMBL25011444 0.86 SMN1; SMN2 (0.43) FABP3FABP4KDM4ETSPOALDH1A1
SCHEMBL465570 0.82 TPMT (0.46) KDM4ETSPOALDH1A1TPMTKMT2A
SCHEMBL26996578 0.79 CNR1 (0.30)
SCHEMBL11466576 0.78 TSPO (0.42) FABP3FABP4KDM4ETSPOALDH1A1
SCHEMBL20285963 0.77 TSHR (0.38) ALDH1A1LMNA
SCHEMBL11466188 0.76 TSPO (0.40) FABP3FABP4KDM4ETSPOALDH1A1
SCHEMBL7526923 0.76 TSPO (0.41) TSPOALDH1A1TPMTLMNASMN1; SMN2
SCHEMBL3937417 0.75 RXRA (0.46) KDM4EALDH1A1TACR1EIF4A3LMNA
Hydrogen Peroxide SCHEMBL11210753 0.73 FABP3 (0.44) FABP3FABP4KDM4EALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300691-B1 PLANT-PROTECTIVE COMPOSITION CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1992-03-04 EP claimed
US-4315017-A Triazole derivatives BASF AKTIENGESELLSCHAFT (DE) 1982-02-09 US claimed
CN-116496182-A Synthesis and application of N, N-dimethylcarbamate compound of isopropyl-substituted cresol 中国林业科学研究院林产化学工业研究所 2023-07-28 CN disclosed
US-6160194-A Soil decontamination using ferric chelates and peroxide THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 2000-12-12 US disclosed
US-5280036-A Containing 4h-1,24-triazole ring BASF AKTIENGESELLSCHAFT (DE) 1994-01-18 US disclosed
US-5232484-A Aqueous acid solution; mineralization; absence of large concentrations of organic solvents, chloride and sulfate THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 1993-08-03 US disclosed
US-5214064-A Insecticides, nematocides, miticides BASF AKTIENGESELLSCHAFT (DE) 1993-05-25 US disclosed
EP-0287959-B1 P-PHENOXY--PHENOXYMETHYL SUBSTITUTED FIVE MEMBERED HETEROAROMATICS BASF Aktiengesellschaft (DE) 1993-04-28 EP disclosed
EP-0289919-B1 N-SUBSTITUTED AZOLES BASF Aktiengesellschaft (DE) 1993-03-17 EP disclosed
US-5187182-A Insecticides, nematocides BASF AKTIENGESELLSCHAFT (DE) 1993-02-16 US disclosed
US-5185359-A N-phenoxphenyloxymethyl substituted azoles and method for controlling pests therewith BASF AKTIENGESELLSCHAFT (DE) 1993-02-09 US disclosed
US-3948940-A Pesticidal phthalimido phosphorous ester compounds CIBA-GEIGY CORPORATION (US) 1976-04-06 US disclosed
US-3941829-A PESTICIDE CIBA-GEIGY CORPORATION (US) 1976-03-02 US disclosed
US-3940412-A 2,4,5-Trichloro- and 2,4,5-tribromoimidazole derivatives and pesticidal compositions containing them CIBA-GEIGY AG (CH) 1976-02-24 US disclosed
US-3935224-A 4H-Pyrido[3,2a]-1,3,2-dioxophosphorane derivatives CIBA-GEIGY CORPORATION (US) 1976-01-27 US disclosed
US-3934010-A MITICIDE CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed
US-3933945-A O-ethyl-S-(n)propyl-S-diallylcarbmoylmethyldithiophosphate CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed
US-3932630-A Triazolyl phosphorus esters as pesticides CIBA-GEIGY CORPORATION (US) 1976-01-13 US disclosed
US-3932629-A Triazolyl phosphorus esters as pesticides CIBA-GEIGY CORPORATION (US) 1976-01-13 US disclosed
US-3932632-A Insecticidal compositions containing an organophosphorus compound and a thiolcarbamate BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-01-13 US disclosed