SCHEMBL6212874

SCHEMBL6212874

O[C@H](CCl)c1ccc(Cl)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADRA2C P18825 1/20 0.51
▸ TP53 P04637 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ KCNH2 Q12809 2/20 0.44
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ GRIN2B Q13224 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ IDO1 P14902 2/20 0.39
▸ TDO2 P48775 1/20 0.39
▸ TOP2A P11388 1/20 0.38
▸ TOP2B Q02880 1/20 0.38

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
SCHEMBL3124491 1.00 ADRA2C (0.51) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL29845931 1.00 ADRA2C (0.51) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL29481560 1.00 ADRA2C (0.51) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL29481563 1.00 ADRA2C (0.51) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL7460986 1.00 ADRA2C (0.51) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL28831343 0.87 ADRA2C (0.43) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL16372279 0.84 ADRA2C (0.49) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL10396657 0.83 LMNA (0.53) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL11452909 0.83 ADRA2C (0.51) ADRA2CTP53LMNAHTTKCNH2
SCHEMBL7453698 0.83 ADRA2C (0.51) ADRA2CTP53LMNAHTTKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116370512-B Celery seed extract, preparation method thereof and application thereof in uric acid reduction 湖州草本连自然疗法研究院 2023-09-29 — — CN claimed
CN-116370512-A Celery seed extract, preparation method thereof and application thereof in uric acid reduction 湖州草本连自然疗法研究院 2023-07-04 — — CN claimed
CN-111073912-B Biological preparation method of (S) -2-chloro-1- (2,4-dichlorophenyl) ethanol 上海医药工业研究院 2022-03-25 — — CN claimed
CN-109574797-B Preparation method of chiral benzyl alcohol 上海彩迩文生化科技有限公司 2021-09-17 — — CN claimed
CN-111875595-A Preparation method of azole antifungal drug 上海福乐医药科技有限公司 2020-11-03 — — CN claimed
CN-111073912-A Biological preparation method of (S) -2-chloro-1- (2,4-dichlorophenyl) ethanol 上海医药工业研究院 2020-04-28 — — CN claimed
CN-117323271-B Acne-removing composition, and preparation method and application thereof 广州百孚润化工有限公司 2024-01-26 — — CN disclosed
CN-117323271-A Acne-removing composition, and preparation method and application thereof 广州百孚润化工有限公司 2024-01-02 — — CN disclosed
CN-116370512-B Celery seed extract, preparation method thereof and application thereof in uric acid reduction 湖州草本连自然疗法研究院 2023-09-29 — — CN disclosed
CN-116370512-A Celery seed extract, preparation method thereof and application thereof in uric acid reduction 湖州草本连自然疗法研究院 2023-07-04 — — CN disclosed
CN-115028586-A Preparation method of chiral (S) -imazalil 池州中瑞化工有限公司 2022-09-09 — — CN disclosed
US-20220235082-A1 CATALYSTS THE UNIVERSITY OF WARWICK (GB) 2022-07-28 — — US disclosed
CN-111073912-B Biological preparation method of (S) -2-chloro-1- (2,4-dichlorophenyl) ethanol 上海医药工业研究院 2022-03-25 — — CN disclosed
EP-1143798-A1 CHIRAL IMIDAZOLE FUNGICIDAL COMPOSITIONS AND METHODS FOR THEIR USE CELGENE CORPORATION (US) 2001-10-17 — — EP disclosed
US-6207695-B1 INHIBITING GROWTH OF FUNGUS IN ASSOCIATION WITH A PLANT COMPRISING APPLYING TO THE LOCUS OF A PLANT A FUNGICIDALLY EFFECTIVE AMOUNT OF THE (S)-ENANTIOMER OF 1-(2-(2,4-DICHLOROPHENYL)-2-(2-PROPENYLOXY)ETHYL)-1H-IMIDAZOLE CELGENE CORPORATION 2001-03-27 — — US disclosed
EP-1026135-A1 Production of optically active 2-halo-1-(substituted phenyl)-ethanol and substituted styrene oxide Nihon Nohyaku Co., Ltd. (JP) 2000-08-09 — — EP disclosed
WO-2000038521-A1 CHIRAL IMIDAZOLE FUNGICIDAL COMPOSITIONS AND METHODS FOR THEIR USE CELGENE CORPORATION (US) 2000-07-06 — — WO disclosed
US-5981807-A REACTING A HALO-SUBSTITUTED PHENYLETHANOL WITH PHTHALIC ANHYDRIDE, PERFORMING OPTICAL RESOLUTION ON THE RESULTING COMPOUND USING AN OPTICALLY ACTIVE ORGANIC AMINE AS A RESOLVING AGENT, PERFORMING HYDROLYSIS OR ALCOHOLYSIS NIHON NOHYAKU CO., LTD. (JP) 1999-11-09 — — US disclosed
US-5756862-A RACEMIZATION WITH ACID CATALYST NIHON NOHYAKU CO., LTD. (JP) 1998-05-26 — — US disclosed
EP-0763513-A2 Production of optically active 2-halo-1-(substituted phenyl)-ethanol and substituted styrene oxide Nihon Nohyaku Co., Ltd. (JP) 1997-03-19 — — EP 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 (1 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-20220235082-A1 CATALYSTS TST, TCP1, CCT3 ADRA2C 4277/4885TP53 2513/4885LMNA 1391/4885

“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.

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