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SCHEMBL28357488

SCHEMBL28357488

CO/C=C(/C(=O)O)c1ccccc1COc1cc(C(C)(C)C)ccn1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ FOLH1 Q04609 1/20 0.34
▸ HIF1A Q16665 2/20 0.33
▸ MRGPRX4 Q96LA9 2/20 0.32
▸ HCAR2 Q8TDS4 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ CHRM5 P08912 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ CHRM3 P20309 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
SCHEMBL29359466 0.91 HIF1A (0.39) HIF1ARXFP1
SCHEMBL8724335 0.83 MAPK1 (0.39) FOLH1TP53HTTCYP2C19
SCHEMBL2108009 0.83 SRC (0.36) HTTCYP2C19RXFP1
SCHEMBL2853900 0.83 SRC (0.36) HTTCYP2C19RXFP1
SCHEMBL2108015 0.83 SRC (0.36) HTTCYP2C19RXFP1
SCHEMBL28357491 0.78 MRGPRX4 (0.32) MRGPRX4TP53HTT
SCHEMBL8639304 0.76 KDM4E (0.47) HIF1ATP53HTT
SCHEMBL7628478 0.75 HIF1A (0.57) HIF1A
SCHEMBL20636585 0.75 HTR7 (0.38) FOLH1HIF1ATP53HTT
SCHEMBL2851880 0.75 GABRA5 (0.42) FOLH1TP53HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108430980-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-09-02 — — CN disclosed
CN-109071520-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-06-14 — — CN disclosed
CN-111050558-B Microbicidal quinoline (thio) carboxamide derivatives 先正达参股股份有限公司 2022-05-27 — — CN disclosed
CN-111093372-B Microbicidal quinoline (thio) carboxamide derivatives 先正达参股股份有限公司 2022-05-27 — — CN disclosed
CN-108137517-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-04-12 — — CN disclosed
CN-109071522-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-04-12 — — CN disclosed
CN-108779109-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-03-11 — — CN disclosed
CN-108137570-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-01-28 — — CN disclosed
CN-109890209-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2021-11-19 — — CN disclosed
CN-108368099-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2021-11-12 — — CN disclosed
CN-112714764-A 3- (2-thienyl) -5- (trifluoromethyl) -1,2, 4-oxadiazole derivatives as agrochemical fungicides 先正达农作物保护股份公司 2021-04-27 — — CN disclosed
CN-108347936-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2021-04-20 — — CN disclosed
CN-112689631-A Microbicidal oxadiazole derivatives 先正达农作物保护股份公司 2021-04-20 — — CN disclosed
CN-112351981-A Microbicidal oxadiazole derivatives 先正达农作物保护股份公司 2021-02-09 — — CN disclosed
CN-112154141-A Microbicidal pyridine carboxamide derivatives 先正达参股股份有限公司 2020-12-29 — — CN disclosed
CN-112041317-A Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2020-12-04 — — CN disclosed
CN-112020503-A Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2020-12-01 — — CN disclosed
CN-111566087-A Microbicidal pyridine carboxamide derivatives 先正达参股股份有限公司 2020-08-21 — — CN disclosed
CN-111406055-A Microbiocidal thiazole derivatives 先正达参股股份有限公司 2020-07-10 — — CN disclosed
CN-110709395-A Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2020-01-17 — — CN disclosed