SCHEMBL29599994

SCHEMBL29599994

Brc1ccc(Oc2cc(Br)c(Br)c(Br)c2Br)cc1Br

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.61
AKR1B1 P15121 5/20 0.41
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALOX15 P16050 2/20 0.37
MAPK1 P28482 2/20 0.34
TSHR P16473 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.32
POLB P06746 2/20 0.32
NQO2 P16083 1/20 0.32
ALDH1A1 P00352 1/20 0.30
KDM4E B2RXH2 1/20 0.30
EGFR P00533 1/20 0.30
KDR P35968 1/20 0.30

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
SCHEMBL16679249 1.00 TDP1 (0.61) TDP1AKR1B1MAPTNPSR1ALOX15
SCHEMBL29492173 0.81 MAPK1 (0.52) TDP1AKR1B1MAPTALOX15MAPK1
SCHEMBL29599189 0.79 APEX1 (0.38) TDP1AKR1B1MAPTNPSR1ALDH1A1
SCHEMBL16678396 0.79 APEX1 (0.38) TDP1AKR1B1MAPTNPSR1ALDH1A1
SCHEMBL14938867 0.78 NR4A1 (0.42) TDP1MAPTMAPK1TSHRL3MBTL1
SCHEMBL943471 0.78 TDP1 (1.00) TDP1AKR1B1MAPTNPSR1ALOX15
SCHEMBL29389799 0.78 TDP1 (1.00) TDP1AKR1B1MAPTNPSR1ALOX15
SCHEMBL29492090 0.78 NR4A1 (0.42) TDP1MAPTMAPK1TSHRL3MBTL1
SCHEMBL755527 0.78 TDP1 (0.64) TDP1AKR1B1ALOX15TSHR
SCHEMBL29634564 0.77 THRA (0.37) TDP1AKR1B1MAPTALOX15

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-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-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
CN-115901973-B Selective separation method of polybrominated diphenyl ether in soil extract by using 13X molecular sieve 中国科学院大连化学物理研究所 2024-12-06 CN 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-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