SCHEMBL522950

SCHEMBL522950

CC(C)CC1CNC(=O)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
NR2F2 P24468 3/20 0.34
LMNA P02545 2/20 0.34
NPC1 O15118 2/20 0.34
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 2/20 0.34
HIF1A Q16665 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
MAPK1 P28482 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
SLC2A1 P11166 1/20 0.34
EIF4A1 P60842 1/20 0.34
FKBP1A P62942 1/20 0.34

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
SCHEMBL21587611 1.00 TSHR (0.37) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL268203 1.00 TSHR (0.37) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL3117336 0.85 TSHR (0.33) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL29332923 0.85 SMN1; SMN2 (0.37) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL6923351 0.84 TSHR (0.35) TSHRPDE4APDE4BPDE4CPDE4D
Valine SCHEMBL576798 0.83 SLC7A5 (0.43) IRAK4
SCHEMBL3123099 0.82 PDE4A (0.39) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL3123114 0.82 PDE4A (0.39) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL27488017 0.82 PDE4A (0.39) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL3114190 0.81 TSHR (0.33) TSHRPDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4143179-B1 AZETIDIN-3-YLMETHANOL DERIVATIVES AS CCR6 RECEPTOR MODULATORS FOR THE TREATMENT OF CANCER IDORSIA PHARMACEUTICALS LTD (CH) 2025-10-22 EP claimed
CN-119569633-A Pregabalin lactam methylene dimer and preparation method thereof 浙江华海药业股份有限公司 2025-03-07 CN claimed
US-12018018-B2 Pregabalin lactam methylene dimer and preparation method therefor ZHEJIANG HUAHAI PHARMACEUTICAL CO., LTD (CN) 2024-06-25 US claimed
CN-117665163-A Method for detecting related substances in pregabalin 上海佰利源医药科技有限公司 2024-03-08 CN claimed
CN-109851543-B Method for preparing S-pregabalin lactam 浙江华海药业股份有限公司 2023-07-07 CN claimed
CN-115475162-B Application of 4-isobutyl-2-pyrrolidone in preparing analgesic drug and analgesic drug 浙江震元制药有限公司 2023-06-02 CN claimed
US-20230106270-A1 Acetaminophen-Pregabalin Combinations And Methods Of Treating Pain NEVAKAR INJECTABLES INC. (US) 2023-04-06 US claimed
US-11547686-B2 Acetaminophen pregabalin combinations and methods of treating pain NEVAKAR INJECTABLES INC. (US) 2023-01-10 US claimed
CN-115475162-A Application of 4-isobutyl-2-pyrrolidone in preparation of analgesic and analgesic drug 浙江震元制药有限公司 2022-12-16 CN claimed
WO-2022256545-A1 INJECTABLE PREGABALIN FORMULATIONS NEVAKAR INJECTABLES INC. (US) 2022-12-08 WO claimed
CN-111432882-A Acetaminophen-pregabalin combinations and methods of treating pain 内瓦卡公司 2020-07-17 CN claimed
CN-110963934-A Method for synthesizing and refining (S) -pregabalin 浙江竹子制药有限公司 2020-04-07 CN claimed
CN-110903228-A Preparation method of 4-isobutyl pyrrolidone by solvent-free method 南通常佑药业科技有限公司 2020-03-24 CN claimed
WO-2019070641-A1 ACETAMINOPHEN-PREGABALIN COMBINATIONS AND METHODS OF TREATING PAIN NEVAKAR INC. (US) 2019-04-11 WO claimed
CN-102952057-B A kind of preparation method of 4-isobutyl-pyrrolidin-2-one ZHEJIANG APELOA HOME PHARMACEUTICAL CO.,LTD. (CN) 2015-09-09 CN claimed
CN-104395286-A Preparation method of lactam compound GUANGDONG HEC PHARMACEUTICAL 2015-03-04 CN claimed
WO-2014005494-A1 METHOD OF PREPARING LACTAM COMPOUND SUNSHINE LAKE PHARMA CO., LTD. (CN) 2014-01-09 WO claimed
CN-102952057-A Preparation method of 4-isobutyl pyrrolidine-2-ketone ZHEJIANG APELOA JIAYUAN PHARMACEUTICAL CO LTD 2013-03-06 CN claimed
EP-1377318-A2 PREGABALIN LACTOSE CONJUGATES Warner-Lambert Company LLC (US) 2004-01-07 EP claimed
WO-2002078747-A2 PREGABALIN LACTOSE CONJUGATES WARNER-LAMBERT COMPANY LLC (US) 2002-10-10 WO claimed

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-12018018-B2 Pregabalin lactam methylene dimer and preparation method therefor GABRD, GABRG2, GABRG1 TSHR 4509/4885PDE4A 4018/4885PDE4B 3329/4885

“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.