Naphthalene

Naphthalene

SCHEMBL15322158

C=O.O=C(O)CC(C(=O)O)S(=O)(=O)O.c1ccc2ccccc2c1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.42
CPA1 P15085 2/20 0.40
CPB1 P15086 1/20 0.40
CPA3 P15088 1/20 0.40
CPB2 Q96IY4 1/20 0.40
CYP2C19 P33261 2/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
GABBR2 O75899 1/20 0.36
GABBR1 Q9UBS5 1/20 0.36
TSHR P16473 2/20 0.36
CYP1A2 P05177 2/20 0.36
PTPN7 P35236 1/20 0.34
CASP1 P29466 1/20 0.34
ALDH1A1 P00352 2/20 0.33

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
Naphthalene SCHEMBL5839060 0.96 SRC (0.44) SRCCPA1CPB1CPA3CPB2
SCHEMBL28128633 0.86 SRC (0.42) SRCCPA1CPB1CPA3CPB2
Formaldehyde SCHEMBL27412351 0.85 TDP1 (0.40) SRC
Formaldehyde SCHEMBL8530315 0.85 TDP1 (0.40) SRC
Phenol SCHEMBL3671181 0.84 SRC (0.44) SRCCPA1CPB1CPA3CPB2
Formaldehyde SCHEMBL11795788 0.83 TDP1 (0.39)
SCHEMBL18141518 0.83 SRC (0.42) SRCCPA1CPB1CPA3CPB2
Aniline SCHEMBL2803039 0.83 POLB (0.44) SRCCPA1CPB1CPA3CPB2
Phenol SCHEMBL27821795 0.83 SRC (0.43) SRCCPA1CPB1CPA3CPB2
SCHEMBL18140728 0.83 SRC (0.42) SRCCPA1CPB1CPA3CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114599644-A Nicotinamide compound and herbicide composition containing the same 韩国化学研究院 2022-06-07 CN disclosed
EP-3479696-B1 PYRIDINE-BASED COMPOUND INCLUDING ISOXAZOLINE RING, AND USE THEREOF AS HERBICIDE MOGHU RES CENTER LTD (KR) 2021-06-09 EP disclosed
CN-109561682-B Pyridines comprising an isoxazoline ring and their use as herbicides 牧牛研究所株式会社 2021-05-11 CN disclosed
WO-2021080330-A1 NICOTINAMIDE COMPOUND AND HERBICIDAL COMPOSITION COMPRISING COMPOUND 한국화학연구원 2021-04-29 WO disclosed
US-10927240-B2 Latex composition for dip-molding, and molded article prepared from same LG CHEM, LTD. 2021-02-23 US disclosed
EP-3412717-B1 LATEX COMPOSITION FOR DIP-MOLDING, AND MOLDED ARTICLE PREPARED FROM SAME LG CHEMICAL LTD (KR) 2020-10-21 EP disclosed
US-20190159450-A1 PYRIDINE-BASED COMPOUND INCLUDING ISOXAZOLINE RING AND USE THEREOF AS HERBICIDE MOGHU RESEARCH CENTER LTD. (KR) 2019-05-30 US disclosed
EP-3479696-A1 PYRIDINE-BASED COMPOUND INCLUDING ISOXAZOLINE RING, AND USE THEREOF AS HERBICIDE Moghu Research Center Ltd. (KR) 2019-05-08 EP disclosed
US-20190106555-A1 Latex Composition For Dip-Molding, And Molded Article Prepared From Same LG CHEM, LTD. (KR) 2019-04-11 US disclosed
US-10206399-B2 Herbicidal composition comprising uracil compound as active ingredient DONGBU FARM HANNONG CO., LTD. (KR) 2019-02-19 US disclosed
EP-3412717-A1 LATEX COMPOSITION FOR DIP-MOLDING, AND MOLDED ARTICLE PREPARED FROM SAME LG Chem, Ltd. (KR) 2018-12-12 EP disclosed
EP-2836072-B1 HERBICIDAL COMPOSITION COMPRISING AN URACIL COMPOUND AS ACTIVE INGREDIENT DONGBU FARM HANNONG CO LTD (KR) 2018-11-21 EP disclosed
EP-2836072-A1 HERBICIDAL COMPOSITION COMPRISING URACIL COMPOUND AS ACTIVE INGREDIENT Dongbu Farm Hannong Co., Ltd. (KR) 2015-02-18 EP disclosed
US-20150024940-A1 HERBICIDAL COMPOSITION COMPRISING URACIL COMPOUND AS ACTIVE INGREDIENT DONGBU FARM HANNONG CO., LTD. (KR) 2015-01-22 US disclosed
WO-2013154396-A1 HERBICIDAL COMPOSITION COMPRISING URACIL COMPOUND AS ACTIVE INGREDIENT DONGBU FARM HANNONG CO., LTD. (KR) 2013-10-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150024940-A1 HERBICIDAL COMPOSITION COMPRISING URACIL COMPOUND AS ACTIVE INGREDIENT UNG, DDT, HDHD5 SRC 3640/4885CPA1 3509/4885CPB1 2603/4885
US-20190159450-A1 PYRIDINE-BASED COMPOUND INCLUDING ISOXAZOLINE RING AND USE THEREOF AS HERBICIDE CYP4X1, CYP3A7, IDH2 SRC 2014/4885CPA1 3359/4885CPB1 3474/4885
US-10206399-B2 Herbicidal composition comprising uracil compound as active ingredient UNG, DDT, HDHD5 SRC 3640/4885CPA1 3509/4885CPB1 2603/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.