SCHEMBL29599332

SCHEMBL29599332

Brc1cc(Br)c(Oc2c(Br)cc(Br)c(Br)c2Br)c(Br)c1Br

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 3/20 0.50
▸ CA4 P22748 3/20 0.50
▸ TDP1 Q9NUW8 1/20 0.48
▸ AKR1B1 P15121 6/20 0.45
▸ ALOX15 P16050 6/20 0.42
▸ ALOX12 P18054 4/20 0.42
▸ APEX1 P27695 1/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA6 P23280 2/20 0.38
▸ MAPT P10636 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ AHR P35869 2/20 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
SCHEMBL16678495 1.00 CA2 (0.50) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL30298321 0.95 CA2 (0.52) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL29599785 0.95 TDP1 (0.50) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL16678555 0.95 TDP1 (0.50) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL29599950 0.90 ALOX15 (0.50) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL16678554 0.90 ALOX15 (0.50) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL29599921 0.85 CA2 (0.48) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL16678758 0.85 CA2 (0.48) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL14938742 0.83 AKR1B1 (0.52) CA2CA4TDP1AKR1B1ALOX15
SCHEMBL29599317 0.83 TDP1 (0.70) CA2CA4TDP1AKR1B1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115184499-B Synergistic detection method of organic chlorine pesticide, halogenated flame retardant and organic phosphate and application 广东省科学院生态环境与土壤研究所 2024-03-05 — — CN claimed
CN-116893235-A Method and kit for determining polychlorinated biphenyl and multi-class brominated flame retardant residues in traditional Chinese medicine 江苏省食品药品监督检验研究院(江苏省食品质量安全监控中心) 2023-10-17 — — CN claimed
CN-113138240-B Method for detecting multiple polybrominated diphenyl ethers in edible fungi and culture medium thereof 上海市农业科学院 2023-02-28 — — CN claimed
CN-115184499-A Synergistic detection method and application of organochlorine pesticide, halogenated flame retardant and organic phosphate 广东省科学院生态环境与土壤研究所 2022-10-14 — — CN claimed
US-20250243146-A1 HIGHLY UNSATURATED FATTY ACID OR HIGHLY UNSATURATED FATTY ACID ETHYL ESTER WITH REDUCED ENVIRONMENTAL POLLUTANTS, AND METHOD FOR PRODUCING SAME NISSUI CORPORATION (JP) 2025-07-31 — — US disclosed
US-12331015-B2 Highly unsaturated fatty acid or highly unsaturated fatty acid ethyl ester with reduced environmental pollutants, and method for producing same NISSUI CORPORATION (JP) 2025-06-17 — — US disclosed
EP-4414356-A2 HIGHLY UNSATURATED FATTY ACID OR HIGHLY UNSATURATED FATTY ACID ETHYL ESTER WITH REDUCED ENVIRONMENTAL POLLUTANTS, AND METHOD FOR PRODUCING SAME Nissui Corporation (JP) 2024-08-14 — — EP disclosed
CN-115184499-B Synergistic detection method of organic chlorine pesticide, halogenated flame retardant and organic phosphate and application 广东省科学院生态环境与土壤研究所 2024-03-05 — — CN disclosed
CN-116893235-A Method and kit for determining polychlorinated biphenyl and multi-class brominated flame retardant residues in traditional Chinese medicine 江苏省食品药品监督检验研究院(江苏省食品质量安全监控中心) 2023-10-17 — — CN disclosed
US-20230183165-A1 HIGHLY UNSATURATED FATTY ACID OR HIGHLY UNSATURATED FATTY ACID ETHYL ESTER WITH REDUCED ENVIRONMENTAL POLLUTANTS, AND METHOD FOR PRODUCING SAME NISSUI CORPORATION (JP) 2023-06-15 — — US disclosed
CN-115901973-A Method for selectively separating polybrominated diphenyl ethers in soil extracting solution by using 13X molecular sieve 中国科学院大连化学物理研究所 2023-04-04 — — CN disclosed
US-11603347-B2 Highly unsaturated fatty acid or highly unsaturated fatty acid ethyl ester with reduced environmental pollutants, and method for producing same NIPPON SUISAN KAISHA, LTD. (JP) 2023-03-14 — — US disclosed
CN-113138240-B Method for detecting multiple polybrominated diphenyl ethers in edible fungi and culture medium thereof 上海市农业科学院 2023-02-28 — — CN disclosed
CN-115184499-A Synergistic detection method and application of organochlorine pesticide, halogenated flame retardant and organic phosphate 广东省科学院生态环境与土壤研究所 2022-10-14 — — CN disclosed
CN-105572280-B Method for removing fat from animal sample by classification 中国环境科学研究院 2022-06-14 — — CN disclosed
CN-114611954-A Ecological risk evaluation method and system for mangrove forest ecosystem 生态环境部华南环境科学研究所 2022-06-10 — — CN disclosed
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