SCHEMBL4900831

SCHEMBL4900831

O=C(O)Cc1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CXCL8 P10145 5/20 0.50
▸ AKR1B1 P15121 2/20 0.48
▸ CLIC1 O00299 1/20 0.47
▸ CLCN2 P51788 1/20 0.47
▸ CAMK2A Q9UQM7 5/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ PTGS2 P35354 3/20 0.47
▸ TTR P02766 2/20 0.47
▸ AKR1B10 O60218 1/20 0.47
▸ UGT1A9 O60656 1/20 0.47
▸ TRPA1 O75762 1/20 0.47
▸ ABCB11 O95342 1/20 0.47
▸ MT-CO2 P00403 1/20 0.47
▸ ALB P02768 1/20 0.47
▸ UGT1A6 P19224 1/20 0.47
▸ UGT1A1 P22309 1/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ CXCR1 P25024 1/20 0.47
▸ ADRA1A P35348 1/20 0.47
▸ AGTR2 P50052 1/20 0.47

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
Hydrochloric Acid SCHEMBL11408340 0.98 CXCL8 (0.49) CXCL8AKR1B1CLIC1CLCN2CAMK2A
SCHEMBL9477716 0.85 AKR1B1 (0.45) CXCL8AKR1B1CLIC1CLCN2CAMK2A
SCHEMBL7186116 0.84 CXCL8 (0.47) CXCL8AKR1B1CLIC1CLCN2CAMK2A
SCHEMBL6136983 0.83 AKR1B1 (0.52) CXCL8AKR1B1CLIC1CLCN2CAMK2A
SCHEMBL21617921 0.82 AKR1B1 (0.45) CXCL8AKR1B1CAMK2APTGS2TTR
SCHEMBL3994639 0.82 CYP3A4 (0.41) CXCL8AKR1B1CLIC1CLCN2CAMK2A
SCHEMBL6137046 0.81 CXCL8 (0.42) CXCL8AKR1B1CLIC1CLCN2CAMK2A
SCHEMBL5152941 0.81 NPSR1 (0.44) ADRA1A
SCHEMBL7192003 0.81 AKR1B1 (0.44) CXCL8AKR1B1CLIC1CLCN2CAMK2A
SCHEMBL8837907 0.80 CYP3A4 (0.39) CYP2C9ADRA1ACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0449975-B1 NON-TIN-BASED, LOW TOXICITY ANTI-FOULING AGENTS BATTELLE MEMORIAL INSTITUTE (US) 1997-04-23 — — EP claimed
US-5441743-A In thermoplastic or thermosetting binder BATTELLE MEMORIAL INSTITUTE (US) 1995-08-15 — — US claimed
WO-1990006975-A1 NON-TIN-BASED, LOW TOXICITY ANTI-FOULING AGENTS BATTELLE MEMORIAL INSTITUTE (US) 1990-06-28 — — WO claimed
JP-55167203-A — — None — — JP disclosed
CN-114956979-B Catalyst system for synthesizing phenylacetic acid from toluene 中国科学技术大学 2023-04-28 — — CN disclosed
US-20230062709-A1 RODENTICIDE BAIT COMPOSITION RECKITT BENCKISER LLC (US) 2023-03-02 — — US disclosed
CN-114956979-A Catalyst system for synthesizing phenylacetic acid from toluene 中国科学技术大学 2022-08-30 — — CN disclosed
CN-114097779-A Foam formulation and device for delivery FMC有限公司 2022-03-01 — — CN disclosed
CN-107922571-B Antifouling composition 巴斯夫聚氨酯特种产品(中国)有限公司 2021-04-30 — — CN disclosed
CN-112250558-A Method for preparing carboxylic acid by one-pot method 湖南大学 2021-01-22 — — CN disclosed
CN-107515213-B Method for remotely detecting phenylacetic acid 上海交通大学 2021-01-22 — — CN disclosed
EP-0167006-A2 Microbial degradation of obnoxious organic wastes into innocuous material OCCIDENTAL CHEMICAL CORPORATION (US) 1986-01-08 — — EP disclosed
US-4493895-A USING PSEUDOMONAS OCCIDENTAL CHEMICAL CORPORATION (US) 1985-01-15 — — US disclosed
US-4477570-A METABOLISM OF HALOGENATED ORGANIC COMPOUNDS BY A CELLS OF A CULTURED PSEUDOMONAS OCCIDENTAL CHEMICAL CORPORATION (US) 1984-10-16 — — US disclosed
EP-0075885-A1 Microorganisms for the microbiol degradation of obnoxious organic wastes into innocuous materials OCCIDENTAL CHEMICAL CORPORATION (US) 1983-04-06 — — EP disclosed
US-4361436-A Composition for plant growth regulation GAF CORPORATION (US) 1982-11-30 — — US disclosed
US-4328026-A PLANT GROWTH REGULATORS, ETHYLENE GENERATORS GAF CORPORATION (US) 1982-05-04 — — US disclosed
JP-S55167203-A HERBICIDE IDEMITSU KOSAN CO LTD 1980-12-26 — — JP disclosed
US-4045210-A FOR USE IN CEREAL CROPS MONSANTO COMPANY (US) 1977-08-30 — — US disclosed
US-4045206-A USED IN CEREAL CROPS MONSANTO COMPANY (US) 1977-08-30 — — US disclosed
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