SCHEMBL516801

SCHEMBL516801

C[C@@H](N)c1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.56
PDE2A O00408 1/20 0.50
IDO1 P14902 2/20 0.48
TDO2 P48775 2/20 0.48
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
AOC3 Q16853 2/20 0.42
ACHE P22303 1/20 0.41
DAO P14920 1/20 0.37
HTT P42858 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC9 Q9UKV0 1/20 0.37

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
SCHEMBL157927 1.00 ADRB2 (0.56) ADRB2PDE2AIDO1TDO2MAOA
SCHEMBL56723 1.00 ADRB2 (0.56) ADRB2PDE2AIDO1TDO2MAOA
Hydrochloric Acid SCHEMBL1887841 0.97 ADRB2 (0.54) ADRB2PDE2AIDO1TDO2MAOA
Hydrochloric Acid SCHEMBL1002687 0.97 ADRB2 (0.54) ADRB2PDE2AIDO1TDO2MAOA
Iodide SCHEMBL28918391 0.97 ADRB2 (0.54) ADRB2PDE2AIDO1TDO2MAOA
Bromide SCHEMBL25231048 0.97 ADRB2 (0.54) ADRB2PDE2AIDO1TDO2MAOA
Hydrochloric Acid SCHEMBL14576625 0.97 ADRB2 (0.54) ADRB2PDE2AIDO1TDO2MAOA
Hydrochloric Acid SCHEMBL29227874 0.91 ADRB2 (0.48) ADRB2PDE2AIDO1TDO2MAOA
Hydrochloric Acid SCHEMBL30939459 0.91 ADRB2 (0.48) ADRB2PDE2AIDO1TDO2MAOA
SCHEMBL4380562 0.87 SOS1 (0.46) ADRB2PDE2AIDO1TDO2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250078176-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2025-03-06 US claimed
CN-118435582-A Environmental attributes of nitrogen-containing chemicals 巴斯夫欧洲公司 2024-08-02 CN claimed
CN-118184650-A 6- (1H-pyrrolo [2,3-b ] pyridin-3-yl) quinazoline-4-amine derivative, and preparation method and application thereof 中国人民解放军北部战区总医院 2024-06-14 CN claimed
WO-2023117926-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2023-06-29 WO claimed
CN-112430247-B Perovskite nanocrystalline material with circular polarization luminescence and up-conversion circular polarization luminescence properties and preparation method and application thereof 国家纳米科学中心 2022-12-09 CN claimed
CN-115101683-A Chiral quasi-two-dimensional formamidine perovskite solar cell and preparation method and application thereof 西北工业大学 2022-09-23 CN claimed
CN-112430247-A Perovskite nanocrystalline material with circular polarization luminescence and up-conversion circular polarization luminescence properties and preparation method and application thereof 国家纳米科学中心 2021-03-02 CN claimed
US-20180099936-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A AbbVie Deutschland GmbH & Co. KG (DE) 2018-04-12 US claimed
EP-2780324-B1 HETEROCYCLIC CARBOXAMIDES USEFUL AS INHIBITORS OF PHOSPHODIESTERASE TYPE 10A ABBVIE DEUTSCHLAND (DE) 2017-05-17 EP claimed
US-20160318871-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A ABBVIE INC. 2016-11-03 US claimed
US-9133187-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2015-09-15 US claimed
EP-2681215-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-04-22 EP claimed
US-20130116229-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A ABBVIE INC. (US) 2013-05-09 US claimed
US-8084630-B2 Process for the synthesis of ramelteon and its intermediates TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-12-27 US claimed
US-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-11-12 US claimed
EP-2098519-A1 Process for the synthesis of ramelteon and its intermediates Teva Pharmaceutical Industries Ltd. (IL) 2009-09-09 EP claimed
US-20090069581-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-03-12 US claimed
CN-115835909-B Cannabinoid receptor type 2 (CB 2) modulators and uses thereof 泰昂治疗公司 2026-05-15 CN disclosed
US-5859008-A Arylalkyl diazinones MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-01-12 US disclosed
US-4988734-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US 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 (5 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-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 ADRB2 1490/4885PDE2A 2285/4885IDO1 4021/4885
US-20160318871-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A PDE3A, PDE5A, PDE3B ADRB2 249/4885PDE2A 4/4885IDO1 287/4885
US-20130116229-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A PDE7A, PDE5A, PDE2A ADRB2 591/4885PDE2A 3/4885IDO1 1702/4885
US-20180099936-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A PDE3A, PDE5A, PDE3B ADRB2 254/4885PDE2A 4/4885IDO1 291/4885
US-20090069581-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 ADRB2 1661/4885PDE2A 3676/4885IDO1 2791/4885

“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.