SCHEMBL853286

SCHEMBL853286

C1=CC2CC1c1ccccc12

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
KDM1A O60341 4/20 0.36
KDM1B Q8NB78 1/20 0.36
HTR2A P28223 2/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL13815519 0.81 HTR2A (0.35) CHRNB4CHRNA3HTR2ASLC6A2SLC6A3
SCHEMBL1201800 0.81 HTR2A (0.35) CHRNB4CHRNA3HTR2ASLC6A2SLC6A3
SCHEMBL5380020 0.78 KDM4E (0.35) KDM1AMEN1KMT2A
SCHEMBL2561353 0.71 SMN1; SMN2 (0.42) HTR2AMEN1KMT2A
SCHEMBL11738033 0.71 CHRNB2 (0.46) HTR2AMEN1KMT2A
SCHEMBL4689201 0.71
SCHEMBL4404195 0.71 CHRNB2 (0.46) KDM1AKDM1B
SCHEMBL4406720 0.69 CHRNB2 (0.47) CHRNB4CHRNA3KDM1AKDM1BHTR2A
SCHEMBL11530896 0.69 CHRNB2 (0.47) HTR2AKMT2ASLC6A2SLC6A3
SCHEMBL7117273 0.69 ALDH1A1 (0.40) KDM1ASLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4114508-B1 A SYSTEM AND METHOD FOR RELEASING A SPECIES OBOE IPR AB (SE) 2025-09-17 EP claimed
WO-2025070288-A1 RESIN COMPOSITION, MOLDED BODY, AND OPTICAL COMPONENT 三井化学株式会社 2025-04-03 WO claimed
US-12240930-B2 Cyclic olefin-based copolymer, cyclic olefin-based copolymer composition, molded article, and medical container MITSUI CHEMICALS, INC. (JP) 2025-03-04 US claimed
US-12209147-B2 Cyclic olefin-based resin composition, molded product, and optical component MITSUI CHEMICALS, INC. (JP) 2025-01-28 US claimed
WO-2024203631-A1 PREPARATION IN CONTAINER, AND PACKAGING 三井化学株式会社 2024-10-03 WO claimed
US-11732075-B2 Cyclic olefin-based copolymer, cyclic olefin-based copolymer composition, molded article, and medical container MITSUI CHEMICALS, INC. (JP) 2023-08-22 US claimed
CN-113906097-B Cyclic olefin resin composition, molded body, and optical member 三井化学株式会社 2023-07-18 CN claimed
US-20230159684-A1 CYCLIC OLEFIN-BASED COPOLYMER, CYCLIC OLEFIN-BASED COPOLYMER COMPOSITION, MOLDED ARTICLE, AND MEDICAL CONTAINER MITSUI CHEMICALS, INC. (JP) 2023-05-25 US claimed
CN-111406079-B Cycloolefin copolymer, cycloolefin copolymer composition, molded article, and medical container 三井化学株式会社 2023-04-04 CN claimed
US-20230076160-A1 A SYSTEM AND METHOD FOR RELEASING A SPECIES OBOE IPR AB (SE) 2023-03-09 US claimed
CN-111406079-A Cycloolefin copolymer, cycloolefin copolymer composition, molded article, and medical container 三井化学株式会社 2020-07-10 CN claimed
WO-2020137709-A1 CYCLIC OLEFIN COPOLYMER FOR OPTICAL MEMBER, CYCLIC OLEFIN COPOLYMER COMPOSITION FOR OPTICAL MEMBER, AND MOLDED ARTICLE 三井化学株式会社 2020-07-02 WO claimed
WO-2020137710-A1 CYCLO-OLEFIN COPOLYMER FOR MEDICAL DEVICES, CYCLO-OLEFIN COPOLYMER COMPOSITION FOR MEDICAL DEVICES, AND MOLDED BODY 三井化学株式会社 2020-07-02 WO claimed
US-20190292389-A1 BISMALEIMIDE-BASED SOLUTION FOR INKJET INK FOR THREE DIMENSIONAL PRINTING SOREQ NUCLEAR RESEARCH CENTER (IL) 2019-09-26 US claimed
CN-103570502-A Preparation method for varenicline intermediate SHANGHAI SYNCORES TECHNOLOGIES INC 2014-02-12 CN claimed
EP-2204369-A1 Process for preparing varenicline and intermediates for use therein Medichem, S.A. (ES) 2010-07-07 EP claimed
US-20090318695-A1 PROCESSES FOR THE PREPARATION OF VARENICLINE AND INTERMEDIATES THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-12-24 US claimed
WO-2009155403-A2 PROCESSES FOR THE PREPARATION OF VARENICLINE AND INTERMEDIATES THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-12-23 WO claimed
CN-101531564-A Method for synthesizing 1,4-dihydro-1,4-methanonaphthalene SHANGHAI RECORD PHARMACEUTICAL 2009-09-16 CN claimed
US-4080491-A CATALYST CONTAINS ORGANOMETALLIC COMPOUND AND THE REACTION PRODUCT OF TUNGSTEN OR MOLYBDENUM OXIDE AND A PHOSPHOROUS HALIDE OR OXYHALIDE SHOWA DENKO K.K. (JA) 1978-03-21 US 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-20090318695-A1 PROCESSES FOR THE PREPARATION OF VARENICLINE AND INTERMEDIATES THEREOF COMT, CYP3A7, CHRNA7 CHRNB4 45/4885CHRNA3 32/4885KDM1A 708/4885

“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.